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E3 ubiquitin-protein ligase TRIM35

E3 ubiquitin-protein ligase that participates in multiple biological processes including cell death, glucose metabolism, and in particular, the innate immune response. Mediates 'Lys-63'-linked polyubiquitination of TRAF3 thereby promoting type I interferon production via RIG-I signaling pathway. Can also catalyze 'Lys-48'-linked polyubiquitination and proteasomal degradation of viral proteins such as influenza virus PB2. Acts as a negative feedback regulator of TLR7- and TLR9-triggered signaling. Mechanistically, promotes the 'Lys-48'-linked ubiquitination of IRF7 and induces its degradation via a proteasome-dependent pathway. Reduces FGFR1-dependent tyrosine phosphorylation of PKM, inhibiting PKM-dependent lactate production, glucose metabolism, and cell growth.

AlphaFold DB , UniProt , Accession A0A2K6C3P9, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene TRIM35, Length 493 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	38.3	Very low	239 Å²	239	140.2 Å²	140.2	100%	1.177	80%	0.797	S	S	*	*				0	115.5	0	-72.4	169.6	160.2	0	0	106.1
2	E	32.5	Very low	38.6	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	80%	0.799	S	S	*	*			cis	-148.5	153.9	-3.3	-81.3	177.1	121.9	0	0	106
3	R	36.2	Very low	39.4	Very low	236 Å²	236	142.2 Å²	142.2	89%	0.891	79%	0.793	S	S	*	*			trans	-91.1	158.3	178.6	-78.7	-180	168.8	-174.2	-3.4	110.9
4	S	32.1	Very low	41.1	Very low	110 Å²	110	135.8 Å²	135.8	77%	0.769	76%	0.762	S	S	*	*			trans	107.9	153.3	144.5	-55	0	0	0	0	116.6
5	P	43.7	Very low	42.9	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	75%	0.746	S	S	*	*			cis	-136.2	161.7	-27.9	30.9	-11.1	0	0	0	115.1
6	D	45.3	Very low	44.5	Very low	150 Å²	150	130.4 Å²	130.4	80%	0.802	72%	0.717	S	S	*	*			trans	-71.8	124.3	160.5	-174.1	12.1	0	0	0	110.1
7	V	33.2	Very low	46.1	Very low	118 Å²	118	129.2 Å²	129.2	72%	0.715	71%	0.706	S	S	*	*			trans	-151.7	104.9	162.8	-177.7	0	0	0	0	110	P9	V7-P9 HydrophobicContact CG1-CG 4.41Å
8	S	46.7	Very low	48	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	70%	0.698	S	S	*	*			trans	-87.8	139.7	149.7	-65.8	0	0	0	0	109.5
9	P	40.5	Very low	50.1	Low	113 Å²	113	122.3 Å²	122.3	73%	0.734	66%	0.663	S	S	*	*			trans	-126.1	122.9	146.7	27.2	-9.9	0	0	0	110.3	V7	V7-P9 HydrophobicContact CG1-CG 4.41Å
10	G	38.9	Very low	51.9	Low	61 Å²	61	119.3 Å²	119.3	63%	0.629	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-62	167.3	162.9	0	0	0	0	0	111.5	S12	G10-S12 PolarHBondContact O-N 3.15Å
11	P	38.3	Very low	53.7	Low	97 Å²	97	113.6 Å²	113.6	63%	0.63	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-62.3	124.4	-174.7	25.1	-31.9	0	0	0	110.9	R13	P11-R13 PolarHBondContact O-N 3.49Å
12	S	41.9	Very low	56.2	Low	118 Å²	118	104.4 Å²	104.4	83%	0.825	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64	116.8	177	63.3	0	0	0	0	110	G10	G10-S12 PolarHBondContact O-N 3.15Å
13	R	49.1	Very low	58.8	Low	189 Å²	189	97.6 Å²	97.6	71%	0.713	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-59.5	147.6	168.5	-75.5	-177.2	169.9	173.3	-1.7	109.7	P11 F15 E18	P11-R13 PolarHBondContact O-N 3.49Å; R13-F15 PolarHBondContact O-N 3.33Å; R13-E18 HydrophobicContact CB-CG 4.41Å
14	S	63.3	Low	61.2	Low	52 Å²	52	88.4 Å²	88.4	36%	0.364	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-65.4	137	173.9	-175.3	0	0	0	0	108.7	K16 E17	S14-K16 PolarHBondContact O-N 3.14Å; S14-E17 PolarHBondContact N-OE2 3.13Å; S14-E17 VanDerWaalsContact N-OE2 3.08Å; S14-E17 WeakPolarHBondContact O-CB 3.49Å; S14-E17 PolarHBondContact O-N 3.45Å
15	F	68.3	Low	63.6	Low	118 Å²	118	91.3 Å²	91.3	52%	0.518	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-29.6	175.7	177.6	-103.6	0	0	0	113.6	R13 L19 L78 L82	R13-F15 PolarHBondContact O-N 3.33Å; F15-L19 HydrophobicContact CD1-CD1 4.4Å; F15-L19 HydrophobicContact CE1-CD1 3.88Å; F15-L19 HydrophobicContact CZ-CD1 4.19Å; F15-L78 HydrophobicContact CZ-CD2 4.44Å; F15-L82 HydrophobicContact CD1-CD1 4.5Å
16	K	67.6	Low	65.6	Low	67 Å²	67	90 Å²	90	29%	0.291	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-33.4	176.9	-57	-165.4	-179.5	-161.8	0	114	S14 E18 L19 L82 E86	S14-K16 PolarHBondContact O-N 3.14Å; K16-E18 VanDerWaalsContact C-N 3.3Å; K16-L19 PolarHBondContact O-N 3.46Å; K16-L82 HydrophobicContact CB-CD2 4.35Å; K16-L82 HydrophobicContact CD-CD1 4.28Å; K16-L82 HydrophobicContact CD-CD2 4.37Å; K16-L82 HydrophobicContact CG-CD1 3.97Å; K16-L82 HydrophobicContact CG-CD2 4.08Å; K16-E86 WeakPolarHBondContact CD-OE1 3.43Å; K16-E86 WeakPolarHBondContact CE-OE1 3.23Å; K16-E86 IonicContact NZ-OE1 3.04Å; K16-E86 PolarHBondContact NZ-OE1 3.07Å
17	E	72.2	Confident	67.6	Low	111 Å²	111	84.8 Å²	84.8	52%	0.519	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-72.9	-26	-179.9	-66	168.7	163.7	0	0	111.7	S14 L19 L20	S14-E17 PolarHBondContact N-OE2 3.13Å; S14-E17 VanDerWaalsContact N-OE2 3.08Å; S14-E17 WeakPolarHBondContact O-CB 3.49Å; S14-E17 PolarHBondContact O-N 3.45Å; E17-L19 PolarHBondContact O-N 3.27Å; E17-L20 PolarHBondContact O-N 3.21Å
18	E	80.8	Confident	70.2	Confident	122 Å²	122	79.8 Å²	79.8	57%	0.57	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-73	-14.5	175.1	-61.5	-174.5	175.9	0	0	113	R13 K16	R13-E18 HydrophobicContact CB-CG 4.41Å; K16-E18 VanDerWaalsContact C-N 3.3Å
19	L	87.3	Confident	72.1	Confident	5 Å²	5	83.9 Å²	83.9	3%	0.026	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-99.1	11.1	179.6	-63.3	178	0	0	0	113.4	F15 K16 E17 P27 F28 L75 L78 V79 L82	F15-L19 HydrophobicContact CD1-CD1 4.4Å; F15-L19 HydrophobicContact CE1-CD1 3.88Å; F15-L19 HydrophobicContact CZ-CD1 4.19Å; K16-L19 PolarHBondContact O-N 3.46Å; E17-L19 PolarHBondContact O-N 3.27Å; L19-P27 WeakPolarHBondContact O-CA 3.2Å; L19-F28 VanDerWaalsContact C-CE2 3.45Å; L19-F28 WeakPolarHBondContact O-CD2 3.42Å; L19-F28 WeakPolarHBondContact O-CE2 3.28Å; L19-F28 PolarHBondContact O-N 2.99Å; L19-F28 VanDerWaalsContact O-N 3.15Å; L19-L75 HydrophobicContact CD2-CD2 3.85Å; L19-L78 HydrophobicContact CD1-CB 4.32Å; L19-L78 HydrophobicContact CD2-CB 4.06Å; L19-L78 HydrophobicContact CD2-CD1 4.44Å; L19-V79 HydrophobicContact CB-CG2 3.95Å; L19-V79 HydrophobicContact CD2-CG2 4.39Å; L19-L82 HydrophobicContact CD1-CB 4.48Å; L19-L82 HydrophobicContact CD1-CD2 4.11Å
20	L	86.8	Confident	74.5	Confident	62 Å²	62	81.9 Å²	81.9	33%	0.325	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-98.3	142.5	179.8	-56.6	179.2	0	0	0	112.2	E17 D26 P27 F28	E17-L20 PolarHBondContact O-N 3.21Å; L20-D26 WeakPolarHBondContact CA-O 3.39Å; L20-P27 HydrophobicContact CD2-CB 4.48Å; L20-P27 HydrophobicContact CD2-CG 3.94Å; L20-F28 WeakPolarHBondContact O-CZ 3.46Å
21	C	89.4	Confident	77.1	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.396	C	S	.	.			trans	-74.7	129.4	173.7	177.9	0	0	0	0	111.7	V23 Y25 D26 F28 C41	C21-V23 PolarHBondContact O-N 3.5Å; C21-V23 PolarHBondContact SG-N 3.2Å; C21-Y25 WeakPolarHBondContact O-CA 3.44Å; C21-Y25 PolarHBondContact O-N 2.94Å; C21-D26 PolarHBondContact N-O 3.47Å; C21-F28 HydrophobicContact CB-CD1 3.73Å; C21-F28 HydrophobicContact CB-CE1 3.73Å; C21-C41 WeakPolarHBondContact CB-SG 3.39Å; C21-C41 PolarHBondContact SG-N 3.27Å
22	A	86.3	Confident	79.8	Confident	46 Å²	46	74.3 Å²	74.3	38%	0.38	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-4.8	179.3	0	0	0	0	0	115.4	F40 V59	A22-F40 HydrophobicContact CB-CE1 4.09Å; A22-V59 HydrophobicContact CB-CG2 3.94Å
23	V	87	Confident	82.2	Confident	49 Å²	49	70.1 Å²	70.1	30%	0.297	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-51.5	178	176.4	0	0	0	0	111.5	C21 F40 C44 P58	C21-V23 PolarHBondContact O-N 3.5Å; C21-V23 PolarHBondContact SG-N 3.2Å; V23-F40 HydrophobicContact CG2-CD1 3.72Å; V23-F40 HydrophobicContact CG2-CE1 4.05Å; V23-C44 HydrophobicContact CB-CB 3.82Å; V23-C44 HydrophobicContact CG1-CB 3.77Å; V23-C44 HydrophobicContact CG2-CB 4.4Å; V23-P58 HydrophobicContact CG2-CB 4.12Å; V23-P58 HydrophobicContact CG2-CG 4.16Å
24	C	86.3	Confident	84.2	Confident	42 Å²	42	61.5 Å²	61.5	28%	0.284	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-10.1	-179.7	64.3	0	0	0	0	114.1	D26	C24-D26 PolarHBondContact O-N 2.93Å; C24-D26 VanDerWaalsContact O-N 3.09Å
25	Y	83.6	Confident	85.4	Confident	172 Å²	172	68.2 Å²	68.2	68%	0.675	32%	0.321	S	S	*	.			trans	58.8	12	-176.3	-59.8	-85.8	0	0	0	115.3	C21	C21-Y25 WeakPolarHBondContact O-CA 3.44Å; C21-Y25 PolarHBondContact O-N 2.94Å
26	D	85.4	Confident	86.5	Confident	87 Å²	87	64.6 Å²	64.6	47%	0.465	31%	0.31	S	S	.	.	S	Bend	trans	-94.5	161.3	172.6	-65.6	-43.9	0	0	0	111.2	L20 C21 C24 F28	L20-D26 WeakPolarHBondContact CA-O 3.39Å; C21-D26 PolarHBondContact N-O 3.47Å; C24-D26 PolarHBondContact O-N 2.93Å; C24-D26 VanDerWaalsContact O-N 3.09Å; D26-F28 PolarHBondContact O-N 3.08Å
27	P	86.2	Confident	87.4	Confident	40 Å²	40	63.5 Å²	63.5	26%	0.26	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-51.1	139.9	168.8	-24.9	33.8	0	0	0	111.4	L19 L20 R29 V79	L19-P27 WeakPolarHBondContact O-CA 3.2Å; L20-P27 HydrophobicContact CD2-CB 4.48Å; L20-P27 HydrophobicContact CD2-CG 3.94Å; P27-R29 PolarHBondContact O-N 3.23Å; P27-V79 HydrophobicContact CB-CG1 3.64Å; P27-V79 HydrophobicContact CB-CG2 4.45Å
28	F	88.2	Confident	88.4	Confident	13 Å²	13	61.3 Å²	61.3	6%	0.057	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-54.9	128.9	-174.6	-66.4	-73.1	0	0	0	112.4	L19 L20 C21 D26 A31 N39 L75 V79	L19-F28 VanDerWaalsContact C-CE2 3.45Å; L19-F28 WeakPolarHBondContact O-CD2 3.42Å; L19-F28 WeakPolarHBondContact O-CE2 3.28Å; L19-F28 PolarHBondContact O-N 2.99Å; L19-F28 VanDerWaalsContact O-N 3.15Å; L20-F28 WeakPolarHBondContact O-CZ 3.46Å; C21-F28 HydrophobicContact CB-CD1 3.73Å; C21-F28 HydrophobicContact CB-CE1 3.73Å; D26-F28 PolarHBondContact O-N 3.08Å; F28-A31 HydrophobicContact CB-CB 3.71Å; F28-A31 HydrophobicContact CD1-CB 4.4Å; F28-A31 HydrophobicContact CG-CB 4.04Å; F28-N39 VanDerWaalsContact CE1-C 3.5Å; F28-N39 HydrophobicContact CE1-CB 3.93Å; F28-N39 WeakPolarHBondContact CE1-O 3.25Å; F28-N39 HydrophobicContact CE2-CB 4.43Å; F28-N39 HydrophobicContact CZ-CB 3.72Å; F28-L75 HydrophobicContact CD2-CD1 4.39Å; F28-L75 HydrophobicContact CE2-CD1 4.21Å; F28-V79 HydrophobicContact CB-CG2 4.2Å; F28-V79 HydrophobicContact CD2-CG2 4.37Å
29	R	87.7	Confident	88.9	Confident	198 Å²	198	57.8 Å²	57.8	75%	0.747	29%	0.292	S	S	*	.	S	Bend	trans	-111	115.4	168.5	-63.6	-173.7	-176	-154.4	1.5	108.4	P27 C41	P27-R29 PolarHBondContact O-N 3.23Å; R29-C41 PolarHBondContact N-SG 3.05Å; R29-C41 WeakPolarHBondContact O-CA 3.41Å; R29-C41 VanDerWaalsContact O-CB 3.29Å; R29-C41 WeakPolarHBondContact O-CB 3.39Å
30	D	90.8	Very high	89.3	Confident	70 Å²	70	57.6 Å²	57.6	37%	0.374	29%	0.291	S	S	.	.	S	Bend	trans	51.3	65.5	-170.8	-171.9	27.1	0	0	0	110.8	V32 R42 N76	D30-V32 PolarHBondContact O-N 3Å; D30-R42 HydrophobicContact CB-CB 4.24Å; D30-R42 WeakPolarHBondContact O-CB 3.46Å; D30-R42 PolarHBondContact O-N 3.46Å; D30-R42 VanDerWaalsContact OD2-CB 3.28Å; D30-R42 WeakPolarHBondContact OD2-CB 3.31Å; D30-R42 WeakPolarHBondContact OD2-CD 3.49Å; D30-R42 IonicContact OD2-NE 3.87Å; D30-R42 PolarHBondContact OD2-NE 3.39Å; D30-N76 PolarHBondContact N-OD1 3.31Å
31	A	93.4	Very high	89.6	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	130.1	-179.7	0	0	0	0	0	110.4	F28 F40 N72 L75 N76	F28-A31 HydrophobicContact CB-CB 3.71Å; F28-A31 HydrophobicContact CD1-CB 4.4Å; F28-A31 HydrophobicContact CG-CB 4.04Å; A31-F40 CarbonylContact C-O 3.53Å; A31-F40 WeakPolarHBondContact CA-O 3.47Å; A31-N72 HydrophobicContact CB-CB 4.16Å; A31-N72 PolarHBondContact O-N 3Å; A31-L75 HydrophobicContact CB-CB 3.75Å; A31-L75 HydrophobicContact CB-CD1 4.38Å; A31-N76 WeakPolarHBondContact CB-OD1 3.49Å; A31-N76 PolarHBondContact N-OD1 2.74Å
32	V	93.9	Very high	89.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.3	173.6	-68.9	0	0	0	0	110	D30 N39 F40 R42 V45 L69 R70	D30-V32 PolarHBondContact O-N 3Å; V32-N39 CarbonylContact O-C 3.5Å; V32-N39 VanDerWaalsContact O-CA 3.29Å; V32-N39 WeakPolarHBondContact O-CA 3.17Å; V32-F40 HydrophobicContact CG2-CB 4.48Å; V32-F40 WeakPolarHBondContact CG2-O 3.35Å; V32-F40 PolarHBondContact N-O 3.13Å; V32-F40 PolarHBondContact O-N 3.03Å; V32-R42 HydrophobicContact CG1-CB 3.85Å; V32-R42 HydrophobicContact CG1-CG 4.24Å; V32-R42 HydrophobicContact CG2-CB 4.31Å; V32-V45 HydrophobicContact CG2-CG1 3.75Å; V32-L69 HydrophobicContact CB-CD2 4.07Å; V32-L69 HydrophobicContact CG2-CD2 3.83Å; V32-R70 CarbonylContact C-O 3.56Å; V32-R70 VanDerWaalsContact CA-O 3.25Å; V32-R70 WeakPolarHBondContact CA-O 3.49Å
33	T	93.3	Very high	89.9	Confident	30 Å²	30	58.2 Å²	58.2	18%	0.184	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.1	178.2	-52.6	0	0	0	0	109.7	N39 R70 N72	T33-N39 WeakPolarHBondContact CB-OD1 3.49Å; T33-N39 WeakPolarHBondContact CG2-OD1 3.37Å; T33-N39 PolarHBondContact OG1-OD1 3.25Å; T33-R70 PolarHBondContact N-O 2.68Å; T33-R70 PolarHBondContact O-N 3.31Å; T33-N72 WeakPolarHBondContact OG1-CB 3.34Å; T33-N72 PolarHBondContact OG1-ND2 3.06Å
34	L	91.1	Very high	90.1	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.037	28%	0.279	C	S	.	.			trans	-79.5	163.3	170.9	-63.3	-175.6	0	0	0	111.2	C36 G37 H38 F40 V45 W49 C57 A64 L69	L34-C36 PolarHBondContact O-N 3.24Å; L34-G37 WeakPolarHBondContact O-CA 3.37Å; L34-G37 PolarHBondContact O-N 3.18Å; L34-H38 PolarHBondContact N-O 3.46Å; L34-F40 HydrophobicContact CD1-CD2 4.03Å; L34-F40 HydrophobicContact CD1-CE2 3.59Å; L34-F40 HydrophobicContact CG-CD2 4.12Å; L34-F40 HydrophobicContact CG-CE2 4.05Å; L34-V45 HydrophobicContact CD1-CG2 4.48Å; L34-V45 HydrophobicContact CD2-CG2 4.42Å; L34-W49 HydrophobicContact CD1-CZ2 4.26Å; L34-W49 HydrophobicContact CD2-CH2 3.53Å; L34-W49 HydrophobicContact CD2-CZ2 3.57Å; L34-C57 HydrophobicContact CD1-CB 3.75Å; L34-A64 HydrophobicContact CD1-CB 4.37Å; L34-A64 HydrophobicContact CD2-CB 4.32Å; L34-L69 HydrophobicContact CD2-CD2 3.49Å; L34-L69 VanDerWaalsContact CD2-CD2 3.49Å
35	R	88.3	Confident	90.3	Very high	193 Å²	193	54.1 Å²	54.1	73%	0.728	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-32	175.7	-71.6	-173.3	175	-163.1	7.8	113.7	G37 D68	R35-G37 PolarHBondContact O-N 2.9Å; R35-D68 HydrophobicContact CG-CB 4.06Å; R35-D68 IonicContact CZ-OD1 3.66Å; R35-D68 IonicContact CZ-OD2 3.69Å; R35-D68 IonicContact NE-OD1 2.83Å; R35-D68 PolarHBondContact NE-OD1 2.69Å; R35-D68 IonicContact NE-OD2 2.72Å; R35-D68 PolarHBondContact NE-OD2 2.75Å; R35-D68 IonicContact NH2-OD1 3.41Å; R35-D68 PolarHBondContact NH2-OD1 2.9Å; R35-D68 IonicContact NH2-OD2 2.69Å; R35-D68 PolarHBondContact NH2-OD2 2.92Å
36	C	90.4	Very high	90.5	Very high	42 Å²	42	47.9 Å²	47.9	28%	0.284	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	3.2	174.7	64.8	0	0	0	0	113.8	L34 H38 C60 D62	L34-C36 PolarHBondContact O-N 3.24Å; C36-H38 VanDerWaalsContact C-N 3.32Å; C36-H38 PolarHBondContact O-N 3.27Å; C36-H38 PolarHBondContact SG-ND1 3.43Å; C36-H38 VanDerWaalsContact SG-ND1 3.42Å; C36-C60 PolarHBondContact SG-SG 3.06Å; C36-D62 HydrophobicContact CB-CB 4.09Å; C36-D62 VanDerWaalsContact CB-OD2 3.22Å; C36-D62 WeakPolarHBondContact CB-OD2 3.3Å
37	G	87.9	Confident	90.6	Very high	44 Å²	44	50.4 Å²	50.4	45%	0.454	25%	0.249	S	C	.	.	S	Bend	trans	84.4	-7.6	176.8	0	0	0	0	0	115.5	L34 R35 N39	L34-G37 WeakPolarHBondContact O-CA 3.37Å; L34-G37 PolarHBondContact O-N 3.18Å; R35-G37 PolarHBondContact O-N 2.9Å; G37-N39 PolarHBondContact O-ND2 3.41Å
38	H	91.9	Very high	90.5	Very high	66 Å²	66	50 Å²	50	31%	0.306	25%	0.247	S	C	.	.			trans	-74.5	142.6	177.2	-69.2	98.5	0	0	0	112.3	L34 C36 F40 V59	L34-H38 PolarHBondContact N-O 3.46Å; C36-H38 VanDerWaalsContact C-N 3.32Å; C36-H38 PolarHBondContact O-N 3.27Å; C36-H38 PolarHBondContact SG-ND1 3.43Å; C36-H38 VanDerWaalsContact SG-ND1 3.42Å; H38-F40 HydrophobicContact CB-CE2 3.59Å; H38-F40 HydrophobicContact CB-CZ 3.82Å; H38-V59 WeakPolarHBondContact NE2-CG1 3.39Å
39	N	92.6	Very high	90.5	Very high	48 Å²	48	50.3 Å²	50.3	26%	0.257	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.8	-174.1	-56	-72.1	0	0	0	111.6	F28 V32 T33 G37 L75	F28-N39 VanDerWaalsContact CE1-C 3.5Å; F28-N39 HydrophobicContact CE1-CB 3.93Å; F28-N39 WeakPolarHBondContact CE1-O 3.25Å; F28-N39 HydrophobicContact CE2-CB 4.43Å; F28-N39 HydrophobicContact CZ-CB 3.72Å; V32-N39 CarbonylContact O-C 3.5Å; V32-N39 VanDerWaalsContact O-CA 3.29Å; V32-N39 WeakPolarHBondContact O-CA 3.17Å; T33-N39 WeakPolarHBondContact CB-OD1 3.49Å; T33-N39 WeakPolarHBondContact CG2-OD1 3.37Å; T33-N39 PolarHBondContact OG1-OD1 3.25Å; G37-N39 PolarHBondContact O-ND2 3.41Å; N39-L75 HydrophobicContact CB-CD1 3.67Å; N39-L75 VanDerWaalsContact CG-CD1 3.41Å
40	F	93.9	Very high	90.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	162.4	-179.6	-56	-81.2	0	0	0	111.2	A22 V23 A31 V32 L34 H38 V45 P58 V59	A22-F40 HydrophobicContact CB-CE1 4.09Å; V23-F40 HydrophobicContact CG2-CD1 3.72Å; V23-F40 HydrophobicContact CG2-CE1 4.05Å; A31-F40 CarbonylContact C-O 3.53Å; A31-F40 WeakPolarHBondContact CA-O 3.47Å; V32-F40 HydrophobicContact CG2-CB 4.48Å; V32-F40 WeakPolarHBondContact CG2-O 3.35Å; V32-F40 PolarHBondContact N-O 3.13Å; V32-F40 PolarHBondContact O-N 3.03Å; L34-F40 HydrophobicContact CD1-CD2 4.03Å; L34-F40 HydrophobicContact CD1-CE2 3.59Å; L34-F40 HydrophobicContact CG-CD2 4.12Å; L34-F40 HydrophobicContact CG-CE2 4.05Å; H38-F40 HydrophobicContact CB-CE2 3.59Å; H38-F40 HydrophobicContact CB-CZ 3.82Å; F40-V45 HydrophobicContact CB-CB 3.97Å; F40-V45 HydrophobicContact CB-CG1 4.41Å; F40-V45 HydrophobicContact CD2-CB 4.49Å; F40-V45 HydrophobicContact CD2-CG2 4.38Å; F40-V45 HydrophobicContact CG-CB 4.3Å; F40-P58 HydrophobicContact CD1-CG 4.39Å; F40-P58 HydrophobicContact CE1-CB 3.94Å; F40-P58 HydrophobicContact CE1-CG 3.92Å; F40-P58 HydrophobicContact CZ-CB 4.15Å; F40-P58 HydrophobicContact CZ-CG 4.03Å; F40-V59 HydrophobicContact CE1-CG2 3.84Å; F40-V59 HydrophobicContact CZ-CB 4.38Å; F40-V59 HydrophobicContact CZ-CG2 3.7Å
41	C	93.8	Very high	89.5	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	135.5	160.8	-56.9	0	0	0	0	108.5	C21 R29 G43 C44 V45	C21-C41 WeakPolarHBondContact CB-SG 3.39Å; C21-C41 PolarHBondContact SG-N 3.27Å; R29-C41 PolarHBondContact N-SG 3.05Å; R29-C41 WeakPolarHBondContact O-CA 3.41Å; R29-C41 VanDerWaalsContact O-CB 3.29Å; R29-C41 WeakPolarHBondContact O-CB 3.39Å; C41-G43 VanDerWaalsContact C-N 3.29Å; C41-G43 PolarHBondContact O-N 2.68Å; C41-C44 HydrophobicContact CB-CB 4.01Å; C41-C44 WeakPolarHBondContact O-CB 3.32Å; C41-C44 PolarHBondContact O-N 2.64Å; C41-V45 PolarHBondContact O-N 2.88Å; C41-V45 VanDerWaalsContact O-N 3.12Å
42	R	92.3	Very high	88.8	Confident	79 Å²	79	53.9 Å²	53.9	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-49.6	-50.7	178.7	-177.5	179.5	-69.8	-88.9	-3.1	112	D30 V32 C44 V45 S46 T71	D30-R42 HydrophobicContact CB-CB 4.24Å; D30-R42 WeakPolarHBondContact O-CB 3.46Å; D30-R42 PolarHBondContact O-N 3.46Å; D30-R42 VanDerWaalsContact OD2-CB 3.28Å; D30-R42 WeakPolarHBondContact OD2-CB 3.31Å; D30-R42 WeakPolarHBondContact OD2-CD 3.49Å; D30-R42 IonicContact OD2-NE 3.87Å; D30-R42 PolarHBondContact OD2-NE 3.39Å; V32-R42 HydrophobicContact CG1-CB 3.85Å; V32-R42 HydrophobicContact CG1-CG 4.24Å; V32-R42 HydrophobicContact CG2-CB 4.31Å; R42-C44 VanDerWaalsContact C-N 3.26Å; R42-C44 PolarHBondContact O-N 3.48Å; R42-V45 WeakPolarHBondContact O-CG1 3.35Å; R42-V45 PolarHBondContact O-N 3.31Å; R42-S46 WeakPolarHBondContact O-CB 3.46Å; R42-S46 PolarHBondContact O-N 3.15Å; R42-S46 PolarHBondContact O-OG 2.82Å; R42-S46 VanDerWaalsContact O-OG 3.04Å; R42-T71 PolarHBondContact NH2-OG1 2.67Å
43	G	89.9	Confident	87.7	Confident	33 Å²	33	61.6 Å²	61.6	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-29.6	179	0	0	0	0	0	114.1	C41 R47	C41-G43 VanDerWaalsContact C-N 3.29Å; C41-G43 PolarHBondContact O-N 2.68Å; G43-R47 VanDerWaalsContact O-CG 3.32Å; G43-R47 WeakPolarHBondContact O-CG 3.47Å; G43-R47 PolarHBondContact O-N 3.34Å; G43-R47 PolarHBondContact O-NE 2.89Å; G43-R47 PolarHBondContact O-NH1 2.75Å
44	C	90.6	Very high	87.2	Confident	6 Å²	6	63.8 Å²	63.8	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-73.7	-46.2	179	-73	0	0	0	0	111.9	V23 C41 R42 R47 C48	V23-C44 HydrophobicContact CB-CB 3.82Å; V23-C44 HydrophobicContact CG1-CB 3.77Å; V23-C44 HydrophobicContact CG2-CB 4.4Å; C41-C44 HydrophobicContact CB-CB 4.01Å; C41-C44 WeakPolarHBondContact O-CB 3.32Å; C41-C44 PolarHBondContact O-N 2.64Å; R42-C44 VanDerWaalsContact C-N 3.26Å; R42-C44 PolarHBondContact O-N 3.48Å; C44-R47 PolarHBondContact SG-NH2 3.05Å; C44-R47 VanDerWaalsContact SG-NH2 3.36Å; C44-C48 PolarHBondContact O-N 3.45Å; C44-C48 VanDerWaalsContact O-N 3.16Å; C44-C48 PolarHBondContact O-SG 3.22Å
45	V	90.7	Very high	86.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-69.6	-37.3	179.4	69.6	0	0	0	0	111.6	V32 L34 F40 C41 R42 C48 W49 L69	V32-V45 HydrophobicContact CG2-CG1 3.75Å; L34-V45 HydrophobicContact CD1-CG2 4.48Å; L34-V45 HydrophobicContact CD2-CG2 4.42Å; F40-V45 HydrophobicContact CB-CB 3.97Å; F40-V45 HydrophobicContact CB-CG1 4.41Å; F40-V45 HydrophobicContact CD2-CB 4.49Å; F40-V45 HydrophobicContact CD2-CG2 4.38Å; F40-V45 HydrophobicContact CG-CB 4.3Å; C41-V45 PolarHBondContact O-N 2.88Å; C41-V45 VanDerWaalsContact O-N 3.12Å; R42-V45 WeakPolarHBondContact O-CG1 3.35Å; R42-V45 PolarHBondContact O-N 3.31Å; V45-C48 WeakPolarHBondContact O-CB 3.4Å; V45-C48 PolarHBondContact O-N 2.93Å; V45-W49 HydrophobicContact CG2-CD2 4.08Å; V45-W49 HydrophobicContact CG2-CE3 4.45Å; V45-W49 HydrophobicContact CG2-CH2 3.96Å; V45-W49 HydrophobicContact CG2-CZ2 3.49Å; V45-W49 VanDerWaalsContact CG2-CZ2 3.49Å; V45-W49 HydrophobicContact CG2-CZ3 4.37Å; V45-W49 PolarHBondContact O-N 3.42Å; V45-W49 VanDerWaalsContact O-N 3.14Å; V45-L69 HydrophobicContact CG1-CD1 4.34Å; V45-L69 HydrophobicContact CG1-CD2 3.87Å
46	S	88.6	Confident	87.1	Confident	40 Å²	40	57.4 Å²	57.4	28%	0.28	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-48.7	174.8	-63.2	0	0	0	0	112.1	R42 C48 W49 E50	R42-S46 WeakPolarHBondContact O-CB 3.46Å; R42-S46 PolarHBondContact O-N 3.15Å; R42-S46 PolarHBondContact O-OG 2.82Å; R42-S46 VanDerWaalsContact O-OG 3.04Å; S46-C48 VanDerWaalsContact C-N 3.28Å; S46-C48 PolarHBondContact O-N 3.16Å; S46-W49 PolarHBondContact O-N 2.52Å; S46-E50 WeakPolarHBondContact O-CG 3.43Å; S46-E50 PolarHBondContact O-N 3.21Å
47	R	86.9	Confident	87	Confident	141 Å²	141	55.4 Å²	55.4	53%	0.532	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-34	176.6	-74.7	-172.7	-60.2	-95.3	3	113.2	G43 C44 W49	G43-R47 VanDerWaalsContact O-CG 3.32Å; G43-R47 WeakPolarHBondContact O-CG 3.47Å; G43-R47 PolarHBondContact O-N 3.34Å; G43-R47 PolarHBondContact O-NE 2.89Å; G43-R47 PolarHBondContact O-NH1 2.75Å; C44-R47 PolarHBondContact SG-NH2 3.05Å; C44-R47 VanDerWaalsContact SG-NH2 3.36Å; R47-W49 VanDerWaalsContact C-N 3.27Å; R47-W49 PolarHBondContact O-N 2.95Å
48	C	84.6	Confident	87	Confident	32 Å²	32	54.7 Å²	54.7	22%	0.216	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-30.1	174.6	-71.7	0	0	0	0	112.6	C44 V45 S46 V51 Q52 P58	C44-C48 PolarHBondContact O-N 3.45Å; C44-C48 VanDerWaalsContact O-N 3.16Å; C44-C48 PolarHBondContact O-SG 3.22Å; V45-C48 WeakPolarHBondContact O-CB 3.4Å; V45-C48 PolarHBondContact O-N 2.93Å; S46-C48 VanDerWaalsContact C-N 3.28Å; S46-C48 PolarHBondContact O-N 3.16Å; C48-V51 VanDerWaalsContact O-CG2 3.31Å; C48-V51 WeakPolarHBondContact O-CG2 3.37Å; C48-Q52 WeakPolarHBondContact O-CG 3.39Å; C48-Q52 PolarHBondContact O-NE2 2.96Å; C48-P58 HydrophobicContact CB-CG 4.41Å
49	W	89	Confident	86.9	Confident	19 Å²	19	55 Å²	55	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-85.6	-27.6	179.3	-65.1	-19	0	0	0	113.5	L34 V45 S46 R47 V51 Q52 P55 T56 A64 P66 L69	L34-W49 HydrophobicContact CD1-CZ2 4.26Å; L34-W49 HydrophobicContact CD2-CH2 3.53Å; L34-W49 HydrophobicContact CD2-CZ2 3.57Å; V45-W49 HydrophobicContact CG2-CD2 4.08Å; V45-W49 HydrophobicContact CG2-CE3 4.45Å; V45-W49 HydrophobicContact CG2-CH2 3.96Å; V45-W49 HydrophobicContact CG2-CZ2 3.49Å; V45-W49 VanDerWaalsContact CG2-CZ2 3.49Å; V45-W49 HydrophobicContact CG2-CZ3 4.37Å; V45-W49 PolarHBondContact O-N 3.42Å; V45-W49 VanDerWaalsContact O-N 3.14Å; S46-W49 PolarHBondContact O-N 2.52Å; R47-W49 VanDerWaalsContact C-N 3.27Å; R47-W49 PolarHBondContact O-N 2.95Å; W49-V51 PolarHBondContact O-N 3.3Å; W49-V51 VanDerWaalsContact O-N 3.14Å; W49-Q52 PolarHBondContact O-N 3.32Å; W49-Q52 VanDerWaalsContact O-N 3.13Å; W49-P55 HydrophobicContact CB-CB 4.27Å; W49-P55 HydrophobicContact CD2-CB 3.76Å; W49-P55 HydrophobicContact CE3-CB 4.41Å; W49-P55 HydrophobicContact CG-CB 3.7Å; W49-T56 PolarHBondContact NE1-O 3.2Å; W49-A64 HydrophobicContact CH2-CB 4.05Å; W49-A64 HydrophobicContact CZ2-CB 3.37Å; W49-P66 HydrophobicContact CE3-CG 3.93Å; W49-P66 HydrophobicContact CZ3-CB 4.26Å; W49-P66 HydrophobicContact CZ3-CG 4.06Å; W49-L69 HydrophobicContact CH2-CD1 4.17Å; W49-L69 HydrophobicContact CH2-CD2 3.62Å; W49-L69 HydrophobicContact CH2-CG 3.8Å; W49-L69 HydrophobicContact CZ3-CD1 3.61Å; W49-L69 HydrophobicContact CZ3-CD2 3.94Å; W49-L69 HydrophobicContact CZ3-CG 3.73Å
50	E	83.3	Confident	86.7	Confident	152 Å²	152	55 Å²	55	71%	0.71	31%	0.31	S	S	*	.	H	α-helix	trans	-56.5	-27.6	173.4	-75	164.6	-161.9	0	0	112.9	S46	S46-E50 WeakPolarHBondContact O-CG 3.43Å; S46-E50 PolarHBondContact O-N 3.21Å
51	V	73.8	Confident	86.4	Confident	124 Å²	124	61.4 Å²	61.4	75%	0.752	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	3.4	-178.1	-61.2	0	0	0	0	113.9	C48 W49	C48-V51 VanDerWaalsContact O-CG2 3.31Å; C48-V51 WeakPolarHBondContact O-CG2 3.37Å; W49-V51 PolarHBondContact O-N 3.3Å; W49-V51 VanDerWaalsContact O-N 3.14Å
52	Q	77.4	Confident	86.2	Confident	67 Å²	67	65.1 Å²	65.1	31%	0.313	36%	0.356	S	S	.	.			trans	-115.2	137.3	-177.6	-70.4	177.8	24.9	0	0	111.5	C48 W49 S54 T56	C48-Q52 WeakPolarHBondContact O-CG 3.39Å; C48-Q52 PolarHBondContact O-NE2 2.96Å; W49-Q52 PolarHBondContact O-N 3.32Å; W49-Q52 VanDerWaalsContact O-N 3.13Å; Q52-S54 PolarHBondContact O-N 3.2Å; Q52-S54 PolarHBondContact OE1-O 3.17Å; Q52-T56 PolarHBondContact OE1-OG1 2.94Å
53	V	72.3	Confident	86	Confident	162 Å²	162	72.8 Å²	72.8	98%	0.982	39%	0.386	S	S	*	.	S	Bend	trans	-63.2	-30.6	174.5	-177.9	0	0	0	0	111.5
54	S	81.6	Confident	85.8	Confident	76 Å²	76	72.3 Å²	72.3	53%	0.531	38%	0.378	S	S	.	.	S	Bend	trans	-135.3	126.3	175.7	61.9	0	0	0	0	110.4	Q52 T56	Q52-S54 PolarHBondContact O-N 3.2Å; Q52-S54 PolarHBondContact OE1-O 3.17Å; S54-T56 PolarHBondContact O-N 3.48Å
55	P	85.9	Confident	85.5	Confident	40 Å²	40	74 Å²	74	26%	0.26	39%	0.39	S	S	.	.			trans	-65.2	124.4	-178.5	-18.2	29.5	0	0	0	112	W49 A64	W49-P55 HydrophobicContact CB-CB 4.27Å; W49-P55 HydrophobicContact CD2-CB 3.76Å; W49-P55 HydrophobicContact CE3-CB 4.41Å; W49-P55 HydrophobicContact CG-CB 3.7Å; P55-A64 WeakPolarHBondContact CB-O 3.46Å; P55-A64 PolarHBondContact O-N 3.28Å
56	T	91.1	Very high	85.1	Confident	26 Å²	26	77.9 Å²	77.9	16%	0.16	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-128.4	156.4	176.2	60.5	0	0	0	0	111.8	W49 Q52 S54 P58 D62	W49-T56 PolarHBondContact NE1-O 3.2Å; Q52-T56 PolarHBondContact OE1-OG1 2.94Å; S54-T56 PolarHBondContact O-N 3.48Å; T56-P58 WeakPolarHBondContact O-CD 3.22Å; T56-D62 CarbonylContact C-O 3.48Å; T56-D62 WeakPolarHBondContact CA-O 3.16Å
57	C	89.7	Confident	84.8	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	44%	0.437	C	S	.	.			trans	-62.4	126.8	171.6	177	0	0	0	0	110.1	L34 V59 C60 K61 D62	L34-C57 HydrophobicContact CD1-CB 3.75Å; C57-V59 PolarHBondContact O-N 3.47Å; C57-V59 VanDerWaalsContact O-N 3.1Å; C57-V59 PolarHBondContact SG-N 2.94Å; C57-C60 VanDerWaalsContact CB-SG 3.56Å; C57-C60 PolarHBondContact SG-SG 3.43Å; C57-K61 VanDerWaalsContact O-CA 3.25Å; C57-K61 WeakPolarHBondContact O-CA 3.47Å; C57-K61 PolarHBondContact O-N 3.27Å; C57-D62 PolarHBondContact N-O 3.35Å
58	P	87.8	Confident	84.5	Confident	29 Å²	29	75.4 Å²	75.4	19%	0.188	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.7	178	-28.5	35.5	0	0	0	114.3	V23 F40 C48 T56 K61	V23-P58 HydrophobicContact CG2-CB 4.12Å; V23-P58 HydrophobicContact CG2-CG 4.16Å; F40-P58 HydrophobicContact CD1-CG 4.39Å; F40-P58 HydrophobicContact CE1-CB 3.94Å; F40-P58 HydrophobicContact CE1-CG 3.92Å; F40-P58 HydrophobicContact CZ-CB 4.15Å; F40-P58 HydrophobicContact CZ-CG 4.03Å; C48-P58 HydrophobicContact CB-CG 4.41Å; T56-P58 WeakPolarHBondContact O-CD 3.22Å; P58-K61 PolarHBondContact O-NZ 2.99Å
59	V	88.7	Confident	84.6	Confident	73 Å²	73	75 Å²	75	44%	0.442	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-64.6	-175.2	178.3	0	0	0	0	112.2	A22 H38 F40 C57	A22-V59 HydrophobicContact CB-CG2 3.94Å; H38-V59 WeakPolarHBondContact NE2-CG1 3.39Å; F40-V59 HydrophobicContact CE1-CG2 3.84Å; F40-V59 HydrophobicContact CZ-CB 4.38Å; F40-V59 HydrophobicContact CZ-CG2 3.7Å; C57-V59 PolarHBondContact O-N 3.47Å; C57-V59 VanDerWaalsContact O-N 3.1Å; C57-V59 PolarHBondContact SG-N 2.94Å
60	C	89.1	Confident	84.7	Confident	48 Å²	48	83.3 Å²	83.3	32%	0.324	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.3	-173.7	63.2	0	0	0	0	114.8	C36 C57 D62	C36-C60 PolarHBondContact SG-SG 3.06Å; C57-C60 VanDerWaalsContact CB-SG 3.56Å; C57-C60 PolarHBondContact SG-SG 3.43Å; C60-D62 PolarHBondContact O-N 2.97Å; C60-D62 VanDerWaalsContact O-N 3.15Å; C60-D62 VanDerWaalsContact SG-CG 3.56Å; C60-D62 PolarHBondContact SG-OD2 3.4Å
61	K	88.3	Confident	85.1	Confident	133 Å²	133	78.4 Å²	78.4	58%	0.578	43%	0.429	S	S	*	.			trans	63.3	7.5	-177.3	-49.8	-54.7	-174.9	-162.8	0	116.2	C57 P58	C57-K61 VanDerWaalsContact O-CA 3.25Å; C57-K61 WeakPolarHBondContact O-CA 3.47Å; C57-K61 PolarHBondContact O-N 3.27Å; P58-K61 PolarHBondContact O-NZ 2.99Å
62	D	89.6	Confident	85.9	Confident	87 Å²	87	74.2 Å²	74.2	47%	0.465	40%	0.403	S	S	.	.			trans	-56.7	144.8	171.5	-71.4	-28	0	0	0	111.7	C36 T56 C57 C60 A64	C36-D62 HydrophobicContact CB-CB 4.09Å; C36-D62 VanDerWaalsContact CB-OD2 3.22Å; C36-D62 WeakPolarHBondContact CB-OD2 3.3Å; T56-D62 CarbonylContact C-O 3.48Å; T56-D62 WeakPolarHBondContact CA-O 3.16Å; C57-D62 PolarHBondContact N-O 3.35Å; C60-D62 PolarHBondContact O-N 2.97Å; C60-D62 VanDerWaalsContact O-N 3.15Å; C60-D62 VanDerWaalsContact SG-CG 3.56Å; C60-D62 PolarHBondContact SG-OD2 3.4Å; D62-A64 PolarHBondContact O-N 3.49Å
63	R	87.5	Confident	86.4	Confident	241 Å²	241	77 Å²	77	91%	0.909	42%	0.416	S	S	*	.	B	Isolated β-bridge	trans	-58.2	132.3	176	-69.2	-173.6	179.5	-153.4	0	110
64	A	85.9	Confident	87.3	Confident	22 Å²	22	73.9 Å²	73.9	18%	0.182	40%	0.397	C	S	.	.			trans	-128.6	167.6	179	0	0	0	0	0	110.4	L34 W49 P55 D62	L34-A64 HydrophobicContact CD1-CB 4.37Å; L34-A64 HydrophobicContact CD2-CB 4.32Å; W49-A64 HydrophobicContact CH2-CB 4.05Å; W49-A64 HydrophobicContact CZ2-CB 3.37Å; P55-A64 WeakPolarHBondContact CB-O 3.46Å; P55-A64 PolarHBondContact O-N 3.28Å; D62-A64 PolarHBondContact O-N 3.49Å
65	S	83.8	Confident	87.6	Confident	42 Å²	42	71.4 Å²	71.4	29%	0.294	38%	0.378	S	S	.	.			trans	-142.6	143.1	175	175.5	0	0	0	0	109.7	A67 D68	S65-A67 PolarHBondContact O-N 3.42Å; S65-A67 PolarHBondContact OG-N 3.09Å; S65-D68 WeakPolarHBondContact CB-OD2 3.44Å; S65-D68 WeakPolarHBondContact O-CB 3.27Å; S65-D68 PolarHBondContact O-N 3.02Å
66	P	82.3	Confident	87.7	Confident	81 Å²	81	71 Å²	71	53%	0.526	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-53.3	-35	170.4	-26	34.6	0	0	0	114.4	W49 D68 L69	W49-P66 HydrophobicContact CE3-CG 3.93Å; W49-P66 HydrophobicContact CZ3-CB 4.26Å; W49-P66 HydrophobicContact CZ3-CG 4.06Å; P66-D68 PolarHBondContact O-N 3.18Å; P66-L69 PolarHBondContact O-N 3.42Å
67	A	82.4	Confident	87.6	Confident	90 Å²	90	74.4 Å²	74.4	74%	0.744	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.4	178	0	0	0	0	0	113	S65	S65-A67 PolarHBondContact O-N 3.42Å; S65-A67 PolarHBondContact OG-N 3.09Å
68	D	81.1	Confident	87.5	Confident	39 Å²	39	77.5 Å²	77.5	21%	0.209	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-94.3	0.9	-176.4	-67.5	-39.3	0	0	0	113.6	R35 S65 P66 R70	R35-D68 HydrophobicContact CG-CB 4.06Å; R35-D68 IonicContact CZ-OD1 3.66Å; R35-D68 IonicContact CZ-OD2 3.69Å; R35-D68 IonicContact NE-OD1 2.83Å; R35-D68 PolarHBondContact NE-OD1 2.69Å; R35-D68 IonicContact NE-OD2 2.72Å; R35-D68 PolarHBondContact NE-OD2 2.75Å; R35-D68 IonicContact NH2-OD1 3.41Å; R35-D68 PolarHBondContact NH2-OD1 2.9Å; R35-D68 IonicContact NH2-OD2 2.69Å; R35-D68 PolarHBondContact NH2-OD2 2.92Å; S65-D68 WeakPolarHBondContact CB-OD2 3.44Å; S65-D68 WeakPolarHBondContact O-CB 3.27Å; S65-D68 PolarHBondContact O-N 3.02Å; P66-D68 PolarHBondContact O-N 3.18Å; D68-R70 PolarHBondContact O-N 2.99Å
69	L	85.7	Confident	87.4	Confident	23 Å²	23	76.4 Å²	76.4	12%	0.12	40%	0.399	C	S	.	.			trans	-70.4	109.6	177.9	-73.7	176	0	0	0	111.2	V32 L34 V45 W49 P66	V32-L69 HydrophobicContact CB-CD2 4.07Å; V32-L69 HydrophobicContact CG2-CD2 3.83Å; L34-L69 HydrophobicContact CD2-CD2 3.49Å; L34-L69 VanDerWaalsContact CD2-CD2 3.49Å; V45-L69 HydrophobicContact CG1-CD1 4.34Å; V45-L69 HydrophobicContact CG1-CD2 3.87Å; W49-L69 HydrophobicContact CH2-CD1 4.17Å; W49-L69 HydrophobicContact CH2-CD2 3.62Å; W49-L69 HydrophobicContact CH2-CG 3.8Å; W49-L69 HydrophobicContact CZ3-CD1 3.61Å; W49-L69 HydrophobicContact CZ3-CD2 3.94Å; W49-L69 HydrophobicContact CZ3-CG 3.73Å; P66-L69 PolarHBondContact O-N 3.42Å
70	R	90.5	Very high	87.3	Confident	195 Å²	195	79.1 Å²	79.1	74%	0.736	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	123.8	174.3	-63	-175.4	-179.6	-172.3	-0.5	110.1	V32 T33 D68 N72	V32-R70 CarbonylContact C-O 3.56Å; V32-R70 VanDerWaalsContact CA-O 3.25Å; V32-R70 WeakPolarHBondContact CA-O 3.49Å; T33-R70 PolarHBondContact N-O 2.68Å; T33-R70 PolarHBondContact O-N 3.31Å; D68-R70 PolarHBondContact O-N 2.99Å; R70-N72 PolarHBondContact O-N 3.41Å
71	T	91.6	Very high	87	Confident	49 Å²	49	82.9 Å²	82.9	30%	0.301	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	129.2	172	-55.1	0	0	0	0	109.7	R42	R42-T71 PolarHBondContact NH2-OG1 2.67Å
72	N	91.1	Very high	86.7	Confident	36 Å²	36	77.3 Å²	77.3	19%	0.193	39%	0.394	C	S	.	.			trans	-100.2	87.1	178.8	-166.3	-38.7	0	0	0	109.9	A31 T33 R70 T74 L75 N76	A31-N72 HydrophobicContact CB-CB 4.16Å; A31-N72 PolarHBondContact O-N 3Å; T33-N72 WeakPolarHBondContact OG1-CB 3.34Å; T33-N72 PolarHBondContact OG1-ND2 3.06Å; R70-N72 PolarHBondContact O-N 3.41Å; N72-T74 VanDerWaalsContact C-N 3.25Å; N72-T74 PolarHBondContact O-N 3.28Å; N72-T74 PolarHBondContact OD1-N 2.98Å; N72-L75 HydrophobicContact CB-CB 4.21Å; N72-L75 HydrophobicContact CB-CD1 4.22Å; N72-L75 HydrophobicContact CB-CG 4.38Å; N72-L75 WeakPolarHBondContact ND2-CD1 3.47Å; N72-L75 PolarHBondContact O-N 2.97Å; N72-L75 PolarHBondContact OD1-N 3.01Å; N72-N76 PolarHBondContact O-N 3.45Å; N72-N76 VanDerWaalsContact O-N 3.13Å; N72-N76 PolarHBondContact O-ND2 3.25Å
73	H	89.3	Confident	86.2	Confident	126 Å²	126	77.1 Å²	77.1	58%	0.583	39%	0.393	S	S	*	.	H	α-helix	trans	-61.4	-33.5	179.7	-63.6	-75.3	0	0	0	112.7	N76 N77	H73-N76 PolarHBondContact O-N 2.92Å; H73-N77 WeakPolarHBondContact O-CB 3.27Å; H73-N77 PolarHBondContact O-N 3.49Å; H73-N77 PolarHBondContact O-ND2 3.49Å; H73-N77 PolarHBondContact O-OD1 2.95Å
74	T	90.1	Very high	85.7	Confident	96 Å²	96	73.4 Å²	73.4	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-63.7	-47.7	177.9	-51	0	0	0	0	111.4	N72 N76 N77 L78	N72-T74 VanDerWaalsContact C-N 3.25Å; N72-T74 PolarHBondContact O-N 3.28Å; N72-T74 PolarHBondContact OD1-N 2.98Å; T74-N76 VanDerWaalsContact C-N 3.34Å; T74-N76 PolarHBondContact O-N 2.94Å; T74-N77 PolarHBondContact O-N 3.36Å; T74-L78 HydrophobicContact CG2-CD1 4.16Å; T74-L78 WeakPolarHBondContact O-CB 3.32Å; T74-L78 VanDerWaalsContact O-CG 3.26Å; T74-L78 WeakPolarHBondContact O-CG 3.45Å; T74-L78 PolarHBondContact O-N 3.09Å
75	L	88.6	Confident	85.1	Confident	24 Å²	24	77.2 Å²	77.2	13%	0.126	39%	0.393	C	S	.	.	H	α-helix	trans	-63.2	-40.5	176.3	-75.2	-178.8	0	0	0	112.1	L19 F28 A31 N39 N72 L78 V79	L19-L75 HydrophobicContact CD2-CD2 3.85Å; F28-L75 HydrophobicContact CD2-CD1 4.39Å; F28-L75 HydrophobicContact CE2-CD1 4.21Å; A31-L75 HydrophobicContact CB-CB 3.75Å; A31-L75 HydrophobicContact CB-CD1 4.38Å; N39-L75 HydrophobicContact CB-CD1 3.67Å; N39-L75 VanDerWaalsContact CG-CD1 3.41Å; N72-L75 HydrophobicContact CB-CB 4.21Å; N72-L75 HydrophobicContact CB-CD1 4.22Å; N72-L75 HydrophobicContact CB-CG 4.38Å; N72-L75 WeakPolarHBondContact ND2-CD1 3.47Å; N72-L75 PolarHBondContact O-N 2.97Å; N72-L75 PolarHBondContact OD1-N 3.01Å; L75-L78 PolarHBondContact O-N 3.46Å; L75-V79 WeakPolarHBondContact O-CB 3.47Å; L75-V79 WeakPolarHBondContact O-CG2 3.27Å; L75-V79 PolarHBondContact O-N 2.97Å
76	N	88.4	Confident	84.4	Confident	32 Å²	32	78.7 Å²	78.7	17%	0.171	40%	0.395	C	S	.	.	H	α-helix	trans	-60	-47.3	174.9	-73.9	-34.1	0	0	0	111.7	D30 A31 N72 H73 T74 L78 V79 E80	D30-N76 PolarHBondContact N-OD1 3.31Å; A31-N76 WeakPolarHBondContact CB-OD1 3.49Å; A31-N76 PolarHBondContact N-OD1 2.74Å; N72-N76 PolarHBondContact O-N 3.45Å; N72-N76 VanDerWaalsContact O-N 3.13Å; N72-N76 PolarHBondContact O-ND2 3.25Å; H73-N76 PolarHBondContact O-N 2.92Å; T74-N76 VanDerWaalsContact C-N 3.34Å; T74-N76 PolarHBondContact O-N 2.94Å; N76-L78 VanDerWaalsContact C-N 3.34Å; N76-L78 PolarHBondContact O-N 3.09Å; N76-V79 PolarHBondContact O-N 2.87Å; N76-E80 WeakPolarHBondContact O-CB 3.19Å; N76-E80 PolarHBondContact O-N 3.32Å
77	N	88.1	Confident	83.5	Confident	97 Å²	97	78.3 Å²	78.3	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-64.9	-37.6	179.5	-67	-12.6	0	0	0	112.2	H73 T74 E80 K81	H73-N77 WeakPolarHBondContact O-CB 3.27Å; H73-N77 PolarHBondContact O-N 3.49Å; H73-N77 PolarHBondContact O-ND2 3.49Å; H73-N77 PolarHBondContact O-OD1 2.95Å; T74-N77 PolarHBondContact O-N 3.36Å; N77-E80 PolarHBondContact O-N 3.28Å; N77-K81 VanDerWaalsContact O-CB 3.3Å; N77-K81 WeakPolarHBondContact O-CB 3.4Å; N77-K81 PolarHBondContact O-N 3.34Å
78	L	87.3	Confident	82.5	Confident	64 Å²	64	79.5 Å²	79.5	34%	0.335	39%	0.389	S	S	.	.	H	α-helix	trans	-67.5	-42.7	176.7	-71.6	172.9	0	0	0	111.7	F15 L19 T74 L75 N76 L82	F15-L78 HydrophobicContact CZ-CD2 4.44Å; L19-L78 HydrophobicContact CD1-CB 4.32Å; L19-L78 HydrophobicContact CD2-CB 4.06Å; L19-L78 HydrophobicContact CD2-CD1 4.44Å; T74-L78 HydrophobicContact CG2-CD1 4.16Å; T74-L78 WeakPolarHBondContact O-CB 3.32Å; T74-L78 VanDerWaalsContact O-CG 3.26Å; T74-L78 WeakPolarHBondContact O-CG 3.45Å; T74-L78 PolarHBondContact O-N 3.09Å; L75-L78 PolarHBondContact O-N 3.46Å; N76-L78 VanDerWaalsContact C-N 3.34Å; N76-L78 PolarHBondContact O-N 3.09Å; L78-L82 VanDerWaalsContact O-CB 3.31Å; L78-L82 WeakPolarHBondContact O-CB 3.31Å; L78-L82 PolarHBondContact O-N 2.53Å
79	V	86.3	Confident	81.2	Confident	6 Å²	6	79.4 Å²	79.4	4%	0.036	40%	0.398	C	S	.	.	H	α-helix	trans	-62.9	-44.4	173.8	169	0	0	0	0	110.8	L19 P27 F28 L75 N76 L82 L83	L19-V79 HydrophobicContact CB-CG2 3.95Å; L19-V79 HydrophobicContact CD2-CG2 4.39Å; P27-V79 HydrophobicContact CB-CG1 3.64Å; P27-V79 HydrophobicContact CB-CG2 4.45Å; F28-V79 HydrophobicContact CB-CG2 4.2Å; F28-V79 HydrophobicContact CD2-CG2 4.37Å; L75-V79 WeakPolarHBondContact O-CB 3.47Å; L75-V79 WeakPolarHBondContact O-CG2 3.27Å; L75-V79 PolarHBondContact O-N 2.97Å; N76-V79 PolarHBondContact O-N 2.87Å; V79-L82 PolarHBondContact O-N 3.45Å; V79-L83 HydrophobicContact CG1-CD1 3.72Å; V79-L83 HydrophobicContact CG1-CG 4.23Å; V79-L83 WeakPolarHBondContact O-CB 3.49Å; V79-L83 WeakPolarHBondContact O-CG 3.45Å; V79-L83 PolarHBondContact O-N 3.5Å
80	E	85.4	Confident	79.4	Confident	131 Å²	131	81.7 Å²	81.7	61%	0.612	42%	0.42	S	S	*	.	H	α-helix	trans	-62.6	-45.1	178.5	-172.8	178.1	-175	0	0	111.9	N76 N77 L82 L83 R84	N76-E80 WeakPolarHBondContact O-CB 3.19Å; N76-E80 PolarHBondContact O-N 3.32Å; N77-E80 PolarHBondContact O-N 3.28Å; E80-L82 PolarHBondContact O-N 2.51Å; E80-L83 PolarHBondContact O-N 3.24Å; E80-R84 WeakPolarHBondContact O-CB 3.42Å; E80-R84 PolarHBondContact O-N 2.9Å
81	K	84.1	Confident	77.4	Confident	126 Å²	126	83.9 Å²	83.9	55%	0.548	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-43.3	176	-170.4	179.8	180	-170.3	0	111.5	N77 R84 E85	N77-K81 VanDerWaalsContact O-CB 3.3Å; N77-K81 WeakPolarHBondContact O-CB 3.4Å; N77-K81 PolarHBondContact O-N 3.34Å; K81-R84 PolarHBondContact O-N 3.04Å; K81-E85 WeakPolarHBondContact CE-OE1 3.13Å; K81-E85 WeakPolarHBondContact O-CB 3.24Å; K81-E85 WeakPolarHBondContact O-CG 3.32Å; K81-E85 PolarHBondContact O-N 3.11Å
82	L	80.8	Confident	75	Confident	16 Å²	16	92.8 Å²	92.8	8%	0.084	46%	0.456	C	S	.	.	H	α-helix	trans	-60.7	-48.1	176	-172.5	81.7	0	0	0	111.4	F15 K16 L19 L78 V79 E80 R84 E85 E86	F15-L82 HydrophobicContact CD1-CD1 4.5Å; K16-L82 HydrophobicContact CB-CD2 4.35Å; K16-L82 HydrophobicContact CD-CD1 4.28Å; K16-L82 HydrophobicContact CD-CD2 4.37Å; K16-L82 HydrophobicContact CG-CD1 3.97Å; K16-L82 HydrophobicContact CG-CD2 4.08Å; L19-L82 HydrophobicContact CD1-CB 4.48Å; L19-L82 HydrophobicContact CD1-CD2 4.11Å; L78-L82 VanDerWaalsContact O-CB 3.31Å; L78-L82 WeakPolarHBondContact O-CB 3.31Å; L78-L82 PolarHBondContact O-N 2.53Å; V79-L82 PolarHBondContact O-N 3.45Å; E80-L82 PolarHBondContact O-N 2.51Å; L82-R84 VanDerWaalsContact C-N 3.27Å; L82-R84 PolarHBondContact O-N 3.06Å; L82-E85 PolarHBondContact O-N 3.42Å; L82-E86 WeakPolarHBondContact O-CB 3.39Å; L82-E86 VanDerWaalsContact O-CG 3.25Å; L82-E86 WeakPolarHBondContact O-CG 3.34Å; L82-E86 PolarHBondContact O-N 2.95Å
83	L	79.4	Confident	72.5	Confident	83 Å²	83	95.8 Å²	95.8	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-63.5	-34.5	179	-70.7	171.8	0	0	0	111.7	V79 E80 A87	V79-L83 HydrophobicContact CG1-CD1 3.72Å; V79-L83 HydrophobicContact CG1-CG 4.23Å; V79-L83 WeakPolarHBondContact O-CB 3.49Å; V79-L83 WeakPolarHBondContact O-CG 3.45Å; V79-L83 PolarHBondContact O-N 3.5Å; E80-L83 PolarHBondContact O-N 3.24Å; L83-A87 VanDerWaalsContact O-CB 3.28Å; L83-A87 WeakPolarHBondContact O-CB 3.3Å; L83-A87 PolarHBondContact O-N 3.1Å
84	R	77.2	Confident	70.1	Confident	163 Å²	163	94.7 Å²	94.7	62%	0.615	48%	0.482	S	S	*	.	H	α-helix	trans	-70.1	-46	175.6	-165.5	179.5	-164.1	-97.5	13.7	112	E80 K81 L82 E86 A87 E88	E80-R84 WeakPolarHBondContact O-CB 3.42Å; E80-R84 PolarHBondContact O-N 2.9Å; K81-R84 PolarHBondContact O-N 3.04Å; L82-R84 VanDerWaalsContact C-N 3.27Å; L82-R84 PolarHBondContact O-N 3.06Å; R84-E86 VanDerWaalsContact C-N 3.3Å; R84-E86 PolarHBondContact O-N 2.76Å; R84-A87 PolarHBondContact O-N 3.12Å; R84-E88 IonicContact CZ-OE1 3.32Å; R84-E88 IonicContact NE-OE1 3Å; R84-E88 IonicContact NH1-OE1 3.22Å; R84-E88 PolarHBondContact NH1-OE1 3.16Å; R84-E88 WeakPolarHBondContact O-CB 3.47Å; R84-E88 VanDerWaalsContact O-CG 3.28Å; R84-E88 WeakPolarHBondContact O-CG 3.4Å; R84-E88 PolarHBondContact O-N 3.41Å
85	E	72.9	Confident	67.8	Low	102 Å²	102	97 Å²	97	48%	0.477	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-36.1	174.1	-73.4	175	180	0	0	111.7	K81 L82 G89	K81-E85 WeakPolarHBondContact CE-OE1 3.13Å; K81-E85 WeakPolarHBondContact O-CB 3.24Å; K81-E85 WeakPolarHBondContact O-CG 3.32Å; K81-E85 PolarHBondContact O-N 3.11Å; L82-E85 PolarHBondContact O-N 3.42Å; E85-G89 PolarHBondContact O-N 2.68Å
86	E	69.4	Low	65.7	Low	74 Å²	74	106.2 Å²	106.2	35%	0.346	51%	0.514	S	S	.	.	H	α-helix	trans	-68.7	-40.1	173.1	-76.3	179.8	165.9	0	0	112.3	K16 L82 R84 G89 A90	K16-E86 WeakPolarHBondContact CD-OE1 3.43Å; K16-E86 WeakPolarHBondContact CE-OE1 3.23Å; K16-E86 IonicContact NZ-OE1 3.04Å; K16-E86 PolarHBondContact NZ-OE1 3.07Å; L82-E86 WeakPolarHBondContact O-CB 3.39Å; L82-E86 VanDerWaalsContact O-CG 3.25Å; L82-E86 WeakPolarHBondContact O-CG 3.34Å; L82-E86 PolarHBondContact O-N 2.95Å; R84-E86 VanDerWaalsContact C-N 3.3Å; R84-E86 PolarHBondContact O-N 2.76Å; E86-G89 PolarHBondContact O-N 2.98Å; E86-A90 VanDerWaalsContact O-CB 3.28Å; E86-A90 WeakPolarHBondContact O-CB 3.43Å; E86-A90 PolarHBondContact O-N 3.14Å
87	A	64	Low	63.9	Low	72 Å²	72	112.7 Å²	112.7	60%	0.595	54%	0.541	S	S	*	.	H	α-helix	trans	-67	-35.4	174.8	0	0	0	0	0	112.3	L83 R84	L83-A87 VanDerWaalsContact O-CB 3.28Å; L83-A87 WeakPolarHBondContact O-CB 3.3Å; L83-A87 PolarHBondContact O-N 3.1Å; R84-A87 PolarHBondContact O-N 3.12Å
88	E	60.6	Low	62.4	Low	115 Å²	115	111.5 Å²	111.5	54%	0.537	54%	0.54	S	S	.	.	H	α-helix	trans	-75	-37.7	175.4	-71.4	170.4	-170.6	0	0	111.6	R84	R84-E88 IonicContact CZ-OE1 3.32Å; R84-E88 IonicContact NE-OE1 3Å; R84-E88 IonicContact NH1-OE1 3.22Å; R84-E88 PolarHBondContact NH1-OE1 3.16Å; R84-E88 WeakPolarHBondContact O-CB 3.47Å; R84-E88 VanDerWaalsContact O-CG 3.28Å; R84-E88 WeakPolarHBondContact O-CG 3.4Å; R84-E88 PolarHBondContact O-N 3.41Å
89	G	54.6	Low	61.5	Low	38 Å²	38	118.6 Å²	118.6	39%	0.392	56%	0.563	S	S	.	*	H	α-helix	trans	-75.7	-17.5	174.6	0	0	0	0	0	115	E85 E86 R91 W92	E85-G89 PolarHBondContact O-N 2.68Å; E86-G89 PolarHBondContact O-N 2.98Å; G89-R91 PolarHBondContact O-N 2.87Å; G89-R91 VanDerWaalsContact O-N 3.1Å; G89-W92 PolarHBondContact O-N 3.38Å; G89-W92 VanDerWaalsContact O-N 3.09Å
90	A	48.6	Very low	61	Low	71 Å²	71	121 Å²	121	59%	0.587	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-10	176.5	0	0	0	0	0	113.8	E86	E86-A90 VanDerWaalsContact O-CB 3.28Å; E86-A90 WeakPolarHBondContact O-CB 3.43Å; E86-A90 PolarHBondContact O-N 3.14Å
91	R	47.9	Very low	60.8	Low	241 Å²	241	115.3 Å²	115.3	91%	0.909	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-16.6	169.9	-92.5	-175.1	-175.3	-172.3	2.5	114.6	G89	G89-R91 PolarHBondContact O-N 2.87Å; G89-R91 VanDerWaalsContact O-N 3.1Å
92	W	41.5	Very low	60.5	Low	236 Å²	236	118.8 Å²	118.8	89%	0.894	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-18	-176.5	-148.5	-75.6	0	0	0	116.3	G89	G89-W92 PolarHBondContact O-N 3.38Å; G89-W92 VanDerWaalsContact O-N 3.09Å
93	T	37	Very low	60.4	Low	99 Å²	99	123.9 Å²	123.9	61%	0.607	59%	0.588	S	S	*	*			trans	-149.9	107	177.1	41.8	0	0	0	0	112.1	Y95	T93-Y95 PolarHBondContact O-N 3.27Å; T93-Y95 VanDerWaalsContact O-N 3.11Å
94	S	39.1	Very low	60.4	Low	102 Å²	102	123.9 Å²	123.9	71%	0.713	59%	0.586	S	S	*	*			trans	-50.4	116.1	156.5	176	0	0	0	0	108.3	R96	S94-R96 PolarHBondContact O-N 3.48Å
95	Y	42.4	Very low	60.4	Low	145 Å²	145	126.3 Å²	126.3	57%	0.569	60%	0.595	S	S	*	*			trans	-68	68.1	175.4	-147.7	-93.1	0	0	0	109.6	T93 F97	T93-Y95 PolarHBondContact O-N 3.27Å; T93-Y95 VanDerWaalsContact O-N 3.11Å; Y95-F97 HydrophobicContact CD1-CE2 4.44Å; Y95-F97 HydrophobicContact CE1-CE1 4.43Å; Y95-F97 HydrophobicContact CE1-CZ 4.36Å; Y95-F97 PolarHBondContact O-N 3.48Å
96	R	44.8	Very low	60.6	Low	218 Å²	218	122.7 Å²	122.7	82%	0.823	59%	0.585	S	S	*	*			trans	-73.8	111.8	157.8	-74	-173.2	-173.7	179.9	3.1	105.3	S94 S98	S94-R96 PolarHBondContact O-N 3.48Å; R96-S98 PolarHBondContact O-N 2.84Å
97	F	51	Low	61.3	Low	167 Å²	167	125.9 Å²	125.9	73%	0.732	60%	0.6	S	S	*	*			trans	-41.3	114.5	162.3	-75	-92.1	0	0	0	108.3	Y95 R99	Y95-F97 HydrophobicContact CD1-CE2 4.44Å; Y95-F97 HydrophobicContact CE1-CE1 4.43Å; Y95-F97 HydrophobicContact CE1-CZ 4.36Å; Y95-F97 PolarHBondContact O-N 3.48Å; F97-R99 PolarHBondContact O-N 3.11Å
98	S	57	Low	62.4	Low	72 Å²	72	124.3 Å²	124.3	50%	0.503	58%	0.581	S	S	.	*			trans	-57.9	118.2	178.7	-168.3	0	0	0	0	107.3	R96 V100	R96-S98 PolarHBondContact O-N 2.84Å; S98-V100 PolarHBondContact O-N 2.92Å; S98-V100 WeakPolarHBondContact OG-CG2 3.29Å
99	R	66.7	Low	63.6	Low	213 Å²	213	121.5 Å²	121.5	80%	0.804	57%	0.574	S	S	*	*	S	Bend	trans	-68.9	7.8	177.3	-65.5	-174.4	177.4	-152.6	0.7	112.5	F97 L108	F97-R99 PolarHBondContact O-N 3.11Å; R99-L108 PolarHBondContact O-N 2.77Å
100	V	77.4	Confident	65.2	Low	57 Å²	57	121 Å²	121	35%	0.345	56%	0.562	S	S	.	*	B	Isolated β-bridge	trans	-121.5	145	179.9	-60.9	0	0	0	0	110.3	S98 G106	S98-V100 PolarHBondContact O-N 2.92Å; S98-V100 WeakPolarHBondContact OG-CG2 3.29Å; V100-G106 CarbonylContact C-O 3.45Å; V100-G106 WeakPolarHBondContact CA-O 3.41Å; V100-G106 WeakPolarHBondContact CB-O 3.43Å
101	C	80.4	Confident	67.2	Low	12 Å²	12	119.1 Å²	119.1	8%	0.081	54%	0.541	C	S	.	.			trans	-57.7	134.4	175.9	176.6	0	0	0	0	110.4	L103 H104 R105 G106 L108 C120 C123	C101-L103 VanDerWaalsContact C-N 3.31Å; C101-L103 PolarHBondContact O-N 2.74Å; C101-H104 HydrophobicContact CB-CB 4.44Å; C101-R105 WeakPolarHBondContact O-CA 3.37Å; C101-R105 PolarHBondContact O-N 3.34Å; C101-G106 PolarHBondContact N-O 3.35Å; C101-L108 HydrophobicContact CB-CD2 3.87Å; C101-C120 HydrophobicContact CB-CB 3.75Å; C101-C120 VanDerWaalsContact CB-SG 3.57Å; C101-C123 PolarHBondContact SG-SG 3Å
102	R	77.6	Confident	69.2	Low	198 Å²	198	107.7 Å²	107.7	75%	0.747	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-32.9	-179.3	-65.5	-177.6	178.8	174.5	0.7	113
103	L	77.9	Confident	71.3	Confident	123 Å²	123	98.9 Å²	98.9	64%	0.644	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-50.4	-177.7	-64.8	171	0	0	0	111.6	C101	C101-L103 VanDerWaalsContact C-N 3.31Å; C101-L103 PolarHBondContact O-N 2.74Å
104	H	80.2	Confident	73.7	Confident	83 Å²	83	98.7 Å²	98.7	38%	0.384	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-5.8	-170.8	-53.9	115.8	0	0	0	113.8	C101 G106 C123	C101-H104 HydrophobicContact CB-CB 4.44Å; H104-G106 PolarHBondContact O-N 2.81Å; H104-C123 VanDerWaalsContact CE1-SG 3.52Å; H104-C123 PolarHBondContact ND1-SG 3.4Å
105	R	76.9	Confident	75.8	Confident	215 Å²	215	96.8 Å²	96.8	81%	0.811	44%	0.442	S	S	*	.			trans	54.4	8.6	-174.5	-55.8	-166.2	179.4	-143.2	2.4	115.3	C101	C101-R105 WeakPolarHBondContact O-CA 3.37Å; C101-R105 PolarHBondContact O-N 3.34Å
106	G	77.9	Confident	77.8	Confident	25 Å²	25	97.6 Å²	97.6	26%	0.258	45%	0.449	S	S	.	.			trans	-82.9	157.9	175.6	0	0	0	0	0	113	V100 C101 H104	V100-G106 CarbonylContact C-O 3.45Å; V100-G106 WeakPolarHBondContact CA-O 3.41Å; V100-G106 WeakPolarHBondContact CB-O 3.43Å; C101-G106 PolarHBondContact N-O 3.35Å; H104-G106 PolarHBondContact O-N 2.81Å
107	Q	83.8	Confident	79.7	Confident	142 Å²	142	91.1 Å²	91.1	66%	0.664	43%	0.428	S	S	*	.	B	Isolated β-bridge	trans	-62.3	135.8	-178.8	-171.8	172.2	13.3	0	0	112.2	S109 C120	Q107-S109 PolarHBondContact O-N 3.46Å; Q107-C120 WeakPolarHBondContact O-CA 3.34Å; Q107-C120 VanDerWaalsContact O-CB 3.26Å; Q107-C120 WeakPolarHBondContact O-CB 3.21Å
108	L	86.3	Confident	81.4	Confident	39 Å²	39	87.4 Å²	87.4	20%	0.204	42%	0.415	C	S	.	.			trans	-76.8	100	173	-64.5	173.6	0	0	0	109.2	R99 C101 L118 L119	R99-L108 PolarHBondContact O-N 2.77Å; C101-L108 HydrophobicContact CB-CD2 3.87Å; L108-L118 HydrophobicContact CB-CB 4.27Å; L108-L118 HydrophobicContact CD1-CB 4.05Å; L108-L118 HydrophobicContact CD1-CD1 4.33Å; L108-L118 HydrophobicContact CD2-CB 4.21Å; L108-L118 WeakPolarHBondContact CD2-O 3.13Å; L108-L118 HydrophobicContact CG-CB 4.4Å; L108-L119 WeakPolarHBondContact CA-O 3.46Å
109	S	86.1	Confident	82.9	Confident	55 Å²	55	84.1 Å²	84.1	39%	0.385	39%	0.392	S	S	.	.			trans	-120.4	-9.8	-175.3	58.8	0	0	0	0	113.6	Q107 L119 P136 V137	Q107-S109 PolarHBondContact O-N 3.46Å; S109-L119 PolarHBondContact N-O 2.8Å; S109-L119 VanDerWaalsContact N-O 3.08Å; S109-P136 WeakPolarHBondContact O-CA 3.38Å; S109-V137 WeakPolarHBondContact O-CG2 3.41Å; S109-V137 PolarHBondContact O-N 3.31Å
110	L	88.8	Confident	83.9	Confident	28 Å²	28	74 Å²	74	15%	0.147	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	154.6	-178.7	-64.4	175.1	0	0	0	111.3	L118 L119 Q124 V134 Q135 V137	L110-L118 CarbonylContact O-C 3.59Å; L110-L118 WeakPolarHBondContact O-CA 3.43Å; L110-L119 HydrophobicContact CB-CB 4.03Å; L110-L119 PolarHBondContact N-O 2.9Å; L110-L119 PolarHBondContact O-N 3.39Å; L110-Q124 HydrophobicContact CD1-CB 4.12Å; L110-Q124 HydrophobicContact CD1-CG 4.47Å; L110-Q124 VanDerWaalsContact CD1-OE1 3.26Å; L110-V134 HydrophobicContact CB-CG1 3.62Å; L110-V134 HydrophobicContact CD1-CG1 4.1Å; L110-V134 HydrophobicContact CD2-CG1 4.24Å; L110-V134 HydrophobicContact CG-CG1 4.19Å; L110-Q135 CarbonylContact C-O 3.55Å; L110-Q135 WeakPolarHBondContact CA-O 3.28Å; L110-V137 VanDerWaalsContact C-CG2 3.48Å; L110-V137 WeakPolarHBondContact O-CG2 3.37Å
111	F	91	Very high	84.1	Confident	32 Å²	32	75.5 Å²	75.5	14%	0.14	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128.4	176.3	-173.8	-90.2	0	0	0	109.7	L113 K116 E117 L118 V134 Q135 V137 T140 F144	F111-L113 HydrophobicContact CD1-CD2 4.01Å; F111-L113 HydrophobicContact CE1-CD2 4.16Å; F111-K116 VanDerWaalsContact CZ-CA 3.47Å; F111-K116 HydrophobicContact CZ-CB 4.03Å; F111-E117 WeakPolarHBondContact CA-O 3.28Å; F111-E117 WeakPolarHBondContact CD2-O 3.22Å; F111-L118 HydrophobicContact CD2-CD2 3.9Å; F111-L118 HydrophobicContact CD2-CG 4.26Å; F111-V134 WeakPolarHBondContact O-CA 3.43Å; F111-Q135 PolarHBondContact N-O 3.13Å; F111-Q135 PolarHBondContact O-N 3.33Å; F111-V137 HydrophobicContact CB-CG2 4.31Å; F111-T140 HydrophobicContact CB-CG2 4.16Å; F111-T140 HydrophobicContact CD1-CG2 3.51Å; F111-T140 HydrophobicContact CE1-CG2 4.05Å; F111-T140 HydrophobicContact CG-CG2 3.94Å; F111-F144 HydrophobicContact CE1-CE2 4.16Å
112	C	89.3	Confident	84.3	Confident	0 Å²	0	78 Å²	78	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	123	172.5	-179	0	0	0	0	109.6	D115 K116 E117 L119 H132 V134	C112-D115 HydrophobicContact CB-CB 4.24Å; C112-D115 PolarHBondContact SG-OD2 3.45Å; C112-K116 VanDerWaalsContact O-CA 3.23Å; C112-K116 WeakPolarHBondContact O-CA 3.41Å; C112-K116 PolarHBondContact O-N 2.81Å; C112-E117 PolarHBondContact N-O 3.03Å; C112-E117 PolarHBondContact O-N 2.67Å; C112-L119 HydrophobicContact CB-CD1 3.94Å; C112-L119 HydrophobicContact CB-CG 4.43Å; C112-H132 VanDerWaalsContact SG-CB 3.58Å; C112-V134 HydrophobicContact CB-CG2 4.44Å
113	L	86.5	Confident	84.6	Confident	51 Å²	51	69 Å²	69	27%	0.267	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-34.2	-176.3	-67.5	176.9	0	0	0	113	F111 R133 T140 F144	F111-L113 HydrophobicContact CD1-CD2 4.01Å; F111-L113 HydrophobicContact CE1-CD2 4.16Å; L113-R133 HydrophobicContact CD1-CB 4.25Å; L113-R133 HydrophobicContact CD1-CG 3.93Å; L113-R133 PolarHBondContact N-O 3.14Å; L113-T140 HydrophobicContact CD2-CG2 3.86Å; L113-F144 HydrophobicContact CD2-CE2 4.45Å
114	E	87.4	Confident	84.8	Confident	96 Å²	96	68 Å²	68	45%	0.449	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-51	-178.9	-67.3	75	-170.4	0	0	110.6	R133	E114-R133 VanDerWaalsContact CD-N 3.33Å; E114-R133 VanDerWaalsContact OE1-CB 3.29Å; E114-R133 WeakPolarHBondContact OE1-CB 3.29Å; E114-R133 PolarHBondContact OE1-N 2.76Å; E114-R133 PolarHBondContact OE2-N 3.22Å
115	D	82.6	Confident	84.7	Confident	61 Å²	61	68.3 Å²	68.3	33%	0.326	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.3	-177.6	-55.4	-47.5	0	0	0	113	C112 E117 H129 H132	C112-D115 HydrophobicContact CB-CB 4.24Å; C112-D115 PolarHBondContact SG-OD2 3.45Å; D115-E117 VanDerWaalsContact C-N 3.28Å; D115-E117 HydrophobicContact CB-CB 4.41Å; D115-E117 HydrophobicContact CB-CG 4.1Å; D115-E117 PolarHBondContact O-N 3.14Å; D115-H129 IonicContact OD2-CE1 3.44Å; D115-H129 PolarHBondContact OD2-CE1 3.33Å; D115-H129 VanDerWaalsContact OD2-CE1 3.31Å; D115-H129 IonicContact OD2-CG 2.6Å; D115-H129 IonicContact OD2-ND1 3.46Å; D115-H129 PolarHBondContact OD2-ND1 3.13Å; D115-H132 IonicContact OD1-CE1 3.63Å; D115-H132 PolarHBondContact OD1-CE1 3.41Å; D115-H132 VanDerWaalsContact OD1-CE1 3.26Å; D115-H132 IonicContact OD1-ND1 2.83Å; D115-H132 PolarHBondContact OD1-ND1 2.82Å; D115-H132 IonicContact OD2-CE1 2.71Å; D115-H132 PolarHBondContact OD2-CE1 2.96Å; D115-H132 VanDerWaalsContact OD2-CE1 3.27Å; D115-H132 IonicContact OD2-CG 3.38Å; D115-H132 IonicContact OD2-ND1 3.93Å; D115-H132 PolarHBondContact OD2-ND1 2.8Å
116	K	84.1	Confident	85.1	Confident	162 Å²	162	59.7 Å²	59.7	70%	0.704	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	34.8	-175.7	-53.6	173.2	-175.6	171.4	0	113.3	F111 C112	F111-K116 VanDerWaalsContact CZ-CA 3.47Å; F111-K116 HydrophobicContact CZ-CB 4.03Å; C112-K116 VanDerWaalsContact O-CA 3.23Å; C112-K116 WeakPolarHBondContact O-CA 3.41Å; C112-K116 PolarHBondContact O-N 2.81Å
117	E	84.7	Confident	85.3	Confident	82 Å²	82	63.3 Å²	63.3	38%	0.383	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.6	-176.3	-65.6	-171.1	161.7	0	0	112.7	F111 C112 D115 L119 H129	F111-E117 WeakPolarHBondContact CA-O 3.28Å; F111-E117 WeakPolarHBondContact CD2-O 3.22Å; C112-E117 PolarHBondContact N-O 3.03Å; C112-E117 PolarHBondContact O-N 2.67Å; D115-E117 VanDerWaalsContact C-N 3.28Å; D115-E117 HydrophobicContact CB-CB 4.41Å; D115-E117 HydrophobicContact CB-CG 4.1Å; D115-E117 PolarHBondContact O-N 3.14Å; E117-L119 HydrophobicContact CB-CD2 4.39Å; E117-H129 IonicContact OE2-CE1 2.76Å; E117-H129 IonicContact OE2-NE2 3.01Å
118	L	87.3	Confident	85.2	Confident	89 Å²	89	62.2 Å²	62.2	47%	0.466	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	129.5	171.1	-71.7	168.5	0	0	0	110.1	L108 L110 F111 V137	L108-L118 HydrophobicContact CB-CB 4.27Å; L108-L118 HydrophobicContact CD1-CB 4.05Å; L108-L118 HydrophobicContact CD1-CD1 4.33Å; L108-L118 HydrophobicContact CD2-CB 4.21Å; L108-L118 WeakPolarHBondContact CD2-O 3.13Å; L108-L118 HydrophobicContact CG-CB 4.4Å; L110-L118 CarbonylContact O-C 3.59Å; L110-L118 WeakPolarHBondContact O-CA 3.43Å; F111-L118 HydrophobicContact CD2-CD2 3.9Å; F111-L118 HydrophobicContact CD2-CG 4.26Å; L118-V137 HydrophobicContact CD2-CB 4.41Å; L118-V137 HydrophobicContact CD2-CG1 4.1Å; L118-V137 HydrophobicContact CD2-CG2 3.38Å
119	L	87.8	Confident	85	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	148	-176.2	-54.8	-175.8	0	0	0	111.2	L108 S109 L110 C112 E117 C123 H129 V134	L108-L119 WeakPolarHBondContact CA-O 3.46Å; S109-L119 PolarHBondContact N-O 2.8Å; S109-L119 VanDerWaalsContact N-O 3.08Å; L110-L119 HydrophobicContact CB-CB 4.03Å; L110-L119 PolarHBondContact N-O 2.9Å; L110-L119 PolarHBondContact O-N 3.39Å; C112-L119 HydrophobicContact CB-CD1 3.94Å; C112-L119 HydrophobicContact CB-CG 4.43Å; E117-L119 HydrophobicContact CB-CD2 4.39Å; L119-C123 HydrophobicContact CB-CB 3.95Å; L119-C123 HydrophobicContact CD2-CB 3.95Å; L119-C123 HydrophobicContact CG-CB 4.4Å; L119-H129 HydrophobicContact CD1-CB 4.39Å; L119-H129 VanDerWaalsContact CD2-NE2 3.3Å; L119-H129 WeakPolarHBondContact CD2-NE2 3.33Å; L119-V134 HydrophobicContact CD1-CG1 4.29Å; L119-V134 HydrophobicContact CD1-CG2 4.12Å
120	C	86.9	Confident	84.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.347	C	S	.	.			trans	-92.5	169.9	160	71.9	0	0	0	0	109.9	C101 Q107 S122 C123 Q124	C101-C120 HydrophobicContact CB-CB 3.75Å; C101-C120 VanDerWaalsContact CB-SG 3.57Å; Q107-C120 WeakPolarHBondContact O-CA 3.34Å; Q107-C120 VanDerWaalsContact O-CB 3.26Å; Q107-C120 WeakPolarHBondContact O-CB 3.21Å; C120-S122 PolarHBondContact O-N 3.32Å; C120-S122 VanDerWaalsContact O-N 3.17Å; C120-C123 WeakPolarHBondContact O-CB 3.14Å; C120-C123 PolarHBondContact O-N 2.92Å; C120-Q124 PolarHBondContact O-N 2.89Å
121	C	82.7	Confident	84.5	Confident	89 Å²	89	68.2 Å²	68.2	60%	0.601	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.6	-178.9	55.4	0	0	0	0	113.7	Q124	C121-Q124 PolarHBondContact O-N 2.78Å
122	S	83.8	Confident	84.5	Confident	65 Å²	65	70 Å²	70	46%	0.455	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-28	178.4	-52.1	0	0	0	0	113.4	C120 Q124	C120-S122 PolarHBondContact O-N 3.32Å; C120-S122 VanDerWaalsContact O-N 3.17Å; S122-Q124 VanDerWaalsContact C-N 3.31Å; S122-Q124 PolarHBondContact O-N 3.36Å
123	C	84.6	Confident	84.4	Confident	8 Å²	8	77 Å²	77	5%	0.054	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-72.3	-23.5	177	-69.9	0	0	0	0	112.8	C101 H104 L119 C120 A125 D126 H129	C101-C123 PolarHBondContact SG-SG 3Å; H104-C123 VanDerWaalsContact CE1-SG 3.52Å; H104-C123 PolarHBondContact ND1-SG 3.4Å; L119-C123 HydrophobicContact CB-CB 3.95Å; L119-C123 HydrophobicContact CD2-CB 3.95Å; L119-C123 HydrophobicContact CG-CB 4.4Å; C120-C123 WeakPolarHBondContact O-CB 3.14Å; C120-C123 PolarHBondContact O-N 2.92Å; C123-A125 PolarHBondContact O-N 2.81Å; C123-D126 WeakPolarHBondContact O-CB 3.46Å; C123-D126 PolarHBondContact O-N 3.21Å; C123-D126 VanDerWaalsContact O-N 3.16Å; C123-H129 PolarHBondContact O-CD2 3.08Å
124	Q	81.3	Confident	84.6	Confident	101 Å²	101	76.1 Å²	76.1	47%	0.472	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-64.7	-31.3	-179.7	-175.5	-178.3	-1.2	0	0	112.3	L110 C120 C121 S122 D126	L110-Q124 HydrophobicContact CD1-CB 4.12Å; L110-Q124 HydrophobicContact CD1-CG 4.47Å; L110-Q124 VanDerWaalsContact CD1-OE1 3.26Å; C120-Q124 PolarHBondContact O-N 2.89Å; C121-Q124 PolarHBondContact O-N 2.78Å; S122-Q124 VanDerWaalsContact C-N 3.31Å; S122-Q124 PolarHBondContact O-N 3.36Å; Q124-D126 VanDerWaalsContact C-N 3.3Å
125	A	80.1	Confident	84.7	Confident	91 Å²	91	73.9 Å²	73.9	75%	0.752	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-87.6	1.1	178.1	0	0	0	0	0	113.2	C123	C123-A125 PolarHBondContact O-N 2.81Å
126	D	83.6	Confident	85.1	Confident	33 Å²	33	73.8 Å²	73.8	18%	0.176	41%	0.405	C	S	.	.	S	Bend	trans	-68	133.5	176.3	-168	-56.6	0	0	0	109.3	C123 Q124 R128 H129 Q130	C123-D126 WeakPolarHBondContact O-CB 3.46Å; C123-D126 PolarHBondContact O-N 3.21Å; C123-D126 VanDerWaalsContact O-N 3.16Å; Q124-D126 VanDerWaalsContact C-N 3.3Å; D126-R128 PolarHBondContact O-N 3.47Å; D126-R128 VanDerWaalsContact OD1-CB 3.27Å; D126-R128 WeakPolarHBondContact OD1-CB 3.37Å; D126-R128 VanDerWaalsContact OD1-CG 3.22Å; D126-R128 WeakPolarHBondContact OD1-CG 3.37Å; D126-R128 IonicContact OD1-CZ 3.54Å; D126-R128 PolarHBondContact OD1-N 2.81Å; D126-R128 IonicContact OD1-NE 3.4Å; D126-R128 PolarHBondContact OD1-NE 2.83Å; D126-R128 IonicContact OD1-NH2 2.65Å; D126-R128 IonicContact OD2-CZ 3.17Å; D126-R128 IonicContact OD2-NE 2.82Å; D126-R128 PolarHBondContact OD2-NE 3.03Å; D126-R128 IonicContact OD2-NH2 3.82Å; D126-R128 PolarHBondContact OD2-NH2 2.9Å; D126-H129 PolarHBondContact O-N 3.24Å; D126-Q130 PolarHBondContact O-N 3.22Å
127	P	83.5	Confident	85.4	Confident	102 Å²	102	68 Å²	68	66%	0.662	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-51.2	-26.8	177	-28	34.8	0	0	0	113.8	H129 Q130	P127-H129 VanDerWaalsContact C-N 3.26Å; P127-H129 PolarHBondContact O-N 3.09Å; P127-Q130 WeakPolarHBondContact O-CB 3.11Å; P127-Q130 PolarHBondContact O-N 2.93Å
128	R	80.1	Confident	85.5	Confident	119 Å²	119	72.3 Å²	72.3	45%	0.449	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-64.5	-24.3	177.9	-66.7	178.9	-66.6	155.8	0	114.5	D126	D126-R128 PolarHBondContact O-N 3.47Å; D126-R128 VanDerWaalsContact OD1-CB 3.27Å; D126-R128 WeakPolarHBondContact OD1-CB 3.37Å; D126-R128 VanDerWaalsContact OD1-CG 3.22Å; D126-R128 WeakPolarHBondContact OD1-CG 3.37Å; D126-R128 IonicContact OD1-CZ 3.54Å; D126-R128 PolarHBondContact OD1-N 2.81Å; D126-R128 IonicContact OD1-NE 3.4Å; D126-R128 PolarHBondContact OD1-NE 2.83Å; D126-R128 IonicContact OD1-NH2 2.65Å; D126-R128 IonicContact OD2-CZ 3.17Å; D126-R128 IonicContact OD2-NE 2.82Å; D126-R128 PolarHBondContact OD2-NE 3.03Å; D126-R128 IonicContact OD2-NH2 3.82Å; D126-R128 PolarHBondContact OD2-NH2 2.9Å
129	H	82.3	Confident	85.5	Confident	8 Å²	8	72 Å²	72	4%	0.037	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-114.2	12.8	178.6	-56.2	-65.9	0	0	0	112.2	D115 E117 L119 C123 D126 P127 G131 H132	D115-H129 IonicContact OD2-CE1 3.44Å; D115-H129 PolarHBondContact OD2-CE1 3.33Å; D115-H129 VanDerWaalsContact OD2-CE1 3.31Å; D115-H129 IonicContact OD2-CG 2.6Å; D115-H129 IonicContact OD2-ND1 3.46Å; D115-H129 PolarHBondContact OD2-ND1 3.13Å; E117-H129 IonicContact OE2-CE1 2.76Å; E117-H129 IonicContact OE2-NE2 3.01Å; L119-H129 HydrophobicContact CD1-CB 4.39Å; L119-H129 VanDerWaalsContact CD2-NE2 3.3Å; L119-H129 WeakPolarHBondContact CD2-NE2 3.33Å; C123-H129 PolarHBondContact O-CD2 3.08Å; D126-H129 PolarHBondContact O-N 3.24Å; P127-H129 VanDerWaalsContact C-N 3.26Å; P127-H129 PolarHBondContact O-N 3.09Å; H129-G131 PolarHBondContact O-N 3.44Å; H129-H132 PolarHBondContact O-N 3.1Å; H129-H132 VanDerWaalsContact O-N 3.15Å
130	Q	84.1	Confident	85.5	Confident	157 Å²	157	72 Å²	72	73%	0.734	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	119.6	-179	-172.7	174.2	2.1	0	0	110.5	D126 P127	D126-Q130 PolarHBondContact O-N 3.22Å; P127-Q130 WeakPolarHBondContact O-CB 3.11Å; P127-Q130 PolarHBondContact O-N 2.93Å
131	G	80.8	Confident	85.6	Confident	83 Å²	83	73.7 Å²	73.7	86%	0.856	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-1.8	-177.9	0	0	0	0	0	115.1	H129	H129-G131 PolarHBondContact O-N 3.44Å
132	H	90.3	Very high	86	Confident	68 Å²	68	74.8 Å²	74.8	32%	0.315	41%	0.409	S	S	.	.			trans	-81	155.3	174.3	-66.9	-176.8	0	0	0	112	C112 D115 H129 V134	C112-H132 VanDerWaalsContact SG-CB 3.58Å; D115-H132 IonicContact OD1-CE1 3.63Å; D115-H132 PolarHBondContact OD1-CE1 3.41Å; D115-H132 VanDerWaalsContact OD1-CE1 3.26Å; D115-H132 IonicContact OD1-ND1 2.83Å; D115-H132 PolarHBondContact OD1-ND1 2.82Å; D115-H132 IonicContact OD2-CE1 2.71Å; D115-H132 PolarHBondContact OD2-CE1 2.96Å; D115-H132 VanDerWaalsContact OD2-CE1 3.27Å; D115-H132 IonicContact OD2-CG 3.38Å; D115-H132 IonicContact OD2-ND1 3.93Å; D115-H132 PolarHBondContact OD2-ND1 2.8Å; H129-H132 PolarHBondContact O-N 3.1Å; H129-H132 VanDerWaalsContact O-N 3.15Å; H132-V134 PolarHBondContact O-N 3.24Å
133	R	88	Confident	86.2	Confident	149 Å²	149	75.5 Å²	75.5	56%	0.562	41%	0.408	S	S	*	.			trans	-85.6	109	179.2	-170.5	172	173.9	-162.1	-0.9	110	L113 E114	L113-R133 HydrophobicContact CD1-CB 4.25Å; L113-R133 HydrophobicContact CD1-CG 3.93Å; L113-R133 PolarHBondContact N-O 3.14Å; E114-R133 VanDerWaalsContact CD-N 3.33Å; E114-R133 VanDerWaalsContact OE1-CB 3.29Å; E114-R133 WeakPolarHBondContact OE1-CB 3.29Å; E114-R133 PolarHBondContact OE1-N 2.76Å; E114-R133 PolarHBondContact OE2-N 3.22Å
134	V	90.3	Very high	86.4	Confident	32 Å²	32	79.5 Å²	79.5	19%	0.194	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.5	179.8	-175.3	0	0	0	0	110.5	L110 F111 C112 L119 H132	L110-V134 HydrophobicContact CB-CG1 3.62Å; L110-V134 HydrophobicContact CD1-CG1 4.1Å; L110-V134 HydrophobicContact CD2-CG1 4.24Å; L110-V134 HydrophobicContact CG-CG1 4.19Å; F111-V134 WeakPolarHBondContact O-CA 3.43Å; C112-V134 HydrophobicContact CB-CG2 4.44Å; L119-V134 HydrophobicContact CD1-CG1 4.29Å; L119-V134 HydrophobicContact CD1-CG2 4.12Å; H132-V134 PolarHBondContact O-N 3.24Å
135	Q	89.6	Confident	86.9	Confident	48 Å²	48	82.8 Å²	82.8	22%	0.224	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	157.9	178.8	-68.9	-171.5	-68.6	0	0	111.6	L110 F111 V137 T140	L110-Q135 CarbonylContact C-O 3.55Å; L110-Q135 WeakPolarHBondContact CA-O 3.28Å; F111-Q135 PolarHBondContact N-O 3.13Å; F111-Q135 PolarHBondContact O-N 3.33Å; Q135-V137 PolarHBondContact O-N 2.79Å; Q135-T140 VanDerWaalsContact CB-OG1 3.31Å; Q135-T140 WeakPolarHBondContact CB-OG1 3.38Å
136	P	91.4	Very high	87.5	Confident	59 Å²	59	79.8 Å²	79.8	38%	0.383	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	140	171.8	-24.4	34.8	0	0	0	111.9	S109 K138 D139 T140	S109-P136 WeakPolarHBondContact O-CA 3.38Å; P136-K138 PolarHBondContact O-N 3.05Å; P136-D139 PolarHBondContact O-N 2.86Å; P136-T140 PolarHBondContact O-N 3.31Å; P136-T140 PolarHBondContact O-OG1 3.25Å
137	V	89.9	Confident	87.9	Confident	40 Å²	40	84.7 Å²	84.7	24%	0.242	43%	0.428	C	S	.	.	H	α-helix	trans	-58.5	-37	179.5	168.7	0	0	0	0	111.4	S109 L110 F111 L118 Q135 D139 A141	S109-V137 WeakPolarHBondContact O-CG2 3.41Å; S109-V137 PolarHBondContact O-N 3.31Å; L110-V137 VanDerWaalsContact C-CG2 3.48Å; L110-V137 WeakPolarHBondContact O-CG2 3.37Å; F111-V137 HydrophobicContact CB-CG2 4.31Å; L118-V137 HydrophobicContact CD2-CB 4.41Å; L118-V137 HydrophobicContact CD2-CG1 4.1Å; L118-V137 HydrophobicContact CD2-CG2 3.38Å; Q135-V137 PolarHBondContact O-N 2.79Å; V137-D139 PolarHBondContact O-N 2.96Å; V137-A141 WeakPolarHBondContact O-CB 3.44Å; V137-A141 PolarHBondContact O-N 3.25Å
138	K	87.1	Confident	88.3	Confident	173 Å²	173	83.9 Å²	83.9	75%	0.752	42%	0.423	S	S	*	.	H	α-helix	trans	-61	-47.2	-178.9	-172.1	-177	176.4	-171.8	0	111.7	P136 H142	P136-K138 PolarHBondContact O-N 3.05Å; K138-H142 WeakPolarHBondContact O-CB 3.41Å; K138-H142 PolarHBondContact O-N 2.96Å
139	D	87.9	Confident	89	Confident	84 Å²	84	84 Å²	84	45%	0.449	42%	0.424	S	S	.	.	H	α-helix	trans	-74.4	-44.3	-175.9	-54.9	-21.8	0	0	0	110.2	P136 V137 A141 H142 D143	P136-D139 PolarHBondContact O-N 2.86Å; V137-D139 PolarHBondContact O-N 2.96Å; D139-A141 PolarHBondContact O-N 2.89Å; D139-H142 WeakPolarHBondContact O-CB 3.26Å; D139-H142 PolarHBondContact O-N 2.83Å; D139-H142 VanDerWaalsContact O-N 3.09Å; D139-D143 PolarHBondContact O-N 3.47Å
140	T	88.3	Confident	89.5	Confident	4 Å²	4	89.3 Å²	89.3	3%	0.025	45%	0.452	C	S	.	.	H	α-helix	trans	-60.8	-45.9	176	-47.4	0	0	0	0	111.1	F111 L113 Q135 P136 H142 D143 F144	F111-T140 HydrophobicContact CB-CG2 4.16Å; F111-T140 HydrophobicContact CD1-CG2 3.51Å; F111-T140 HydrophobicContact CE1-CG2 4.05Å; F111-T140 HydrophobicContact CG-CG2 3.94Å; L113-T140 HydrophobicContact CD2-CG2 3.86Å; Q135-T140 VanDerWaalsContact CB-OG1 3.31Å; Q135-T140 WeakPolarHBondContact CB-OG1 3.38Å; P136-T140 PolarHBondContact O-N 3.31Å; P136-T140 PolarHBondContact O-OG1 3.25Å; T140-H142 VanDerWaalsContact C-N 3.29Å; T140-H142 PolarHBondContact O-N 2.81Å; T140-D143 PolarHBondContact O-N 3.41Å; T140-F144 HydrophobicContact CG2-CD2 3.67Å; T140-F144 HydrophobicContact CG2-CE2 3.65Å; T140-F144 VanDerWaalsContact O-CD2 3.3Å; T140-F144 WeakPolarHBondContact O-CD2 3.5Å; T140-F144 PolarHBondContact O-N 3.49Å
141	A	88.6	Confident	90	Very high	34 Å²	34	87.8 Å²	87.8	28%	0.281	45%	0.447	S	S	.	.	H	α-helix	trans	-63.9	-34.4	176	0	0	0	0	0	112.2	V137 D139 R145	V137-A141 WeakPolarHBondContact O-CB 3.44Å; V137-A141 PolarHBondContact O-N 3.25Å; D139-A141 PolarHBondContact O-N 2.89Å; A141-R145 VanDerWaalsContact O-CB 3.22Å; A141-R145 WeakPolarHBondContact O-CB 3.34Å; A141-R145 WeakPolarHBondContact O-CD 3.46Å; A141-R145 WeakPolarHBondContact O-CG 3.4Å; A141-R145 PolarHBondContact O-N 3.33Å
142	H	90.6	Very high	90.7	Very high	113 Å²	113	88 Å²	88	52%	0.523	43%	0.426	S	S	.	.	H	α-helix	trans	-60.8	-47.4	173.8	176	-87.1	0	0	0	111.2	K138 D139 T140 R145 A146	K138-H142 WeakPolarHBondContact O-CB 3.41Å; K138-H142 PolarHBondContact O-N 2.96Å; D139-H142 WeakPolarHBondContact O-CB 3.26Å; D139-H142 PolarHBondContact O-N 2.83Å; D139-H142 VanDerWaalsContact O-N 3.09Å; T140-H142 VanDerWaalsContact C-N 3.29Å; T140-H142 PolarHBondContact O-N 2.81Å; H142-R145 PolarHBondContact O-N 2.83Å; H142-A146 PolarHBondContact O-N 2.82Å
143	D	88	Confident	90.9	Very high	79 Å²	79	90.2 Å²	90.2	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-67	-44.2	-179.9	-69.1	-9.7	0	0	0	112.5	D139 T140 R145 A146 K147	D139-D143 PolarHBondContact O-N 3.47Å; T140-D143 PolarHBondContact O-N 3.41Å; D143-R145 VanDerWaalsContact C-N 3.34Å; D143-R145 PolarHBondContact O-N 3.28Å; D143-A146 WeakPolarHBondContact O-CB 3.38Å; D143-A146 PolarHBondContact O-N 3.06Å; D143-K147 PolarHBondContact O-N 3.49Å
144	F	88.4	Confident	91.2	Very high	93 Å²	93	85.3 Å²	85.3	41%	0.408	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-40.1	174.1	-86.1	-83.1	0	0	0	111.6	F111 L113 T140 A146 K147 C148	F111-F144 HydrophobicContact CE1-CE2 4.16Å; L113-F144 HydrophobicContact CD2-CE2 4.45Å; T140-F144 HydrophobicContact CG2-CD2 3.67Å; T140-F144 HydrophobicContact CG2-CE2 3.65Å; T140-F144 VanDerWaalsContact O-CD2 3.3Å; T140-F144 WeakPolarHBondContact O-CD2 3.5Å; T140-F144 PolarHBondContact O-N 3.49Å; F144-A146 VanDerWaalsContact C-N 3.32Å; F144-A146 PolarHBondContact O-N 2.85Å; F144-K147 PolarHBondContact O-N 3.48Å; F144-C148 PolarHBondContact O-N 3.48Å; F144-C148 PolarHBondContact O-SG 3.47Å
145	R	92.1	Very high	91.4	Very high	169 Å²	169	88.7 Å²	88.7	64%	0.638	44%	0.444	S	S	*	.	H	α-helix	trans	-62.8	-37.7	173.3	-74.7	170.7	-173.4	-150.1	2.9	111.8	A141 H142 D143 C148 R149	A141-R145 VanDerWaalsContact O-CB 3.22Å; A141-R145 WeakPolarHBondContact O-CB 3.34Å; A141-R145 WeakPolarHBondContact O-CD 3.46Å; A141-R145 WeakPolarHBondContact O-CG 3.4Å; A141-R145 PolarHBondContact O-N 3.33Å; H142-R145 PolarHBondContact O-N 2.83Å; D143-R145 VanDerWaalsContact C-N 3.34Å; D143-R145 PolarHBondContact O-N 3.28Å; R145-C148 PolarHBondContact O-N 3.16Å; R145-R149 WeakPolarHBondContact O-CG 3.49Å; R145-R149 PolarHBondContact O-N 3.46Å
146	A	93.1	Very high	91.6	Very high	28 Å²	28	93.7 Å²	93.7	23%	0.231	46%	0.461	C	S	.	.	H	α-helix	trans	-64.3	-44.9	175	0	0	0	0	0	111.7	H142 D143 F144 C148 R149 N150	H142-A146 PolarHBondContact O-N 2.82Å; D143-A146 WeakPolarHBondContact O-CB 3.38Å; D143-A146 PolarHBondContact O-N 3.06Å; F144-A146 VanDerWaalsContact C-N 3.32Å; F144-A146 PolarHBondContact O-N 2.85Å; A146-C148 VanDerWaalsContact C-N 3.35Å; A146-C148 PolarHBondContact O-N 3.37Å; A146-R149 PolarHBondContact O-N 2.81Å; A146-N150 PolarHBondContact O-N 2.88Å
147	K	91.3	Very high	91.8	Very high	136 Å²	136	94.5 Å²	94.5	59%	0.591	46%	0.459	S	S	*	.	H	α-helix	trans	-59.3	-43.8	173.1	-70.3	176	-178.6	175	0	112	D143 F144 R149 N150 M151	D143-K147 PolarHBondContact O-N 3.49Å; F144-K147 PolarHBondContact O-N 3.48Å; K147-R149 PolarHBondContact O-N 3.38Å; K147-N150 PolarHBondContact O-N 2.92Å; K147-M151 PolarHBondContact O-N 3.38Å
148	C	92.2	Very high	92	Very high	85 Å²	85	99 Å²	99	57%	0.574	48%	0.476	S	S	*	.	H	α-helix	trans	-61.8	-41.9	175.6	-69.4	0	0	0	0	112.1	F144 R145 A146 N150 M151 E152	F144-C148 PolarHBondContact O-N 3.48Å; F144-C148 PolarHBondContact O-SG 3.47Å; R145-C148 PolarHBondContact O-N 3.16Å; A146-C148 VanDerWaalsContact C-N 3.35Å; A146-C148 PolarHBondContact O-N 3.37Å; C148-N150 VanDerWaalsContact C-N 3.34Å; C148-N150 PolarHBondContact O-N 2.87Å; C148-M151 PolarHBondContact O-N 2.86Å; C148-E152 WeakPolarHBondContact O-CB 3.36Å; C148-E152 PolarHBondContact O-N 2.88Å
149	R	94.4	Very high	92.3	Very high	122 Å²	122	92.8 Å²	92.8	46%	0.46	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-40.3	174.8	-76	-173.4	-64.2	-94.4	4	112.3	R145 A146 K147 E152 H153	R145-R149 WeakPolarHBondContact O-CG 3.49Å; R145-R149 PolarHBondContact O-N 3.46Å; A146-R149 PolarHBondContact O-N 2.81Å; K147-R149 PolarHBondContact O-N 3.38Å; R149-E152 PolarHBondContact O-N 3Å; R149-H153 WeakPolarHBondContact O-CB 3.35Å; R149-H153 PolarHBondContact O-N 2.85Å
150	N	93.8	Very high	92.7	Very high	119 Å²	119	94.5 Å²	94.5	64%	0.636	46%	0.46	S	S	*	.	H	α-helix	trans	-65.2	-42.3	176	-69.5	-10	0	0	0	111.8	A146 K147 C148 H153 A154	A146-N150 PolarHBondContact O-N 2.88Å; K147-N150 PolarHBondContact O-N 2.92Å; C148-N150 VanDerWaalsContact C-N 3.34Å; C148-N150 PolarHBondContact O-N 2.87Å; N150-H153 PolarHBondContact O-N 3.35Å; N150-A154 PolarHBondContact O-N 2.67Å
151	M	93.8	Very high	93	Very high	126 Å²	126	97.2 Å²	97.2	62%	0.621	48%	0.483	S	S	*	.	H	α-helix	trans	-64	-43.1	175.2	-169.9	67.1	72.6	0	0	111.6	K147 C148 H153 A154 L155	K147-M151 PolarHBondContact O-N 3.38Å; C148-M151 PolarHBondContact O-N 2.86Å; M151-H153 VanDerWaalsContact C-N 3.34Å; M151-H153 PolarHBondContact O-N 3.03Å; M151-A154 PolarHBondContact O-N 3.33Å; M151-L155 HydrophobicContact CG-CD1 4.48Å; M151-L155 WeakPolarHBondContact O-CG 3.22Å; M151-L155 PolarHBondContact O-N 2.95Å
152	E	95.1	Very high	93.2	Very high	87 Å²	87	103 Å²	103	41%	0.407	50%	0.502	S	S	.	.	H	α-helix	trans	-58.4	-46.1	174.7	-172.3	-155.9	157.5	0	0	111.1	C148 R149 L155 R156	C148-E152 WeakPolarHBondContact O-CB 3.36Å; C148-E152 PolarHBondContact O-N 2.88Å; R149-E152 PolarHBondContact O-N 3Å; E152-L155 PolarHBondContact O-N 3.34Å; E152-R156 WeakPolarHBondContact O-CG 3.42Å; E152-R156 PolarHBondContact O-N 3.05Å; E152-R156 IonicContact OE1-CZ 2.85Å; E152-R156 IonicContact OE1-NE 3.64Å; E152-R156 PolarHBondContact OE1-NE 3.19Å; E152-R156 IonicContact OE1-NH2 3.22Å; E152-R156 PolarHBondContact OE1-NH2 3.15Å
153	H	95	Very high	93.4	Very high	114 Å²	114	104.6 Å²	104.6	53%	0.528	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-46.2	176.5	-177.5	59.6	0	0	0	111.7	R149 N150 M151 L155 R156 E157	R149-H153 WeakPolarHBondContact O-CB 3.35Å; R149-H153 PolarHBondContact O-N 2.85Å; N150-H153 PolarHBondContact O-N 3.35Å; M151-H153 VanDerWaalsContact C-N 3.34Å; M151-H153 PolarHBondContact O-N 3.03Å; H153-L155 VanDerWaalsContact C-N 3.3Å; H153-L155 PolarHBondContact O-N 2.93Å; H153-R156 WeakPolarHBondContact O-CB 3.43Å; H153-R156 PolarHBondContact O-N 2.99Å; H153-R156 VanDerWaalsContact O-N 3.11Å; H153-E157 IonicContact CE1-OE1 3.66Å; H153-E157 PolarHBondContact O-N 3.46Å
154	A	94.4	Very high	93.7	Very high	46 Å²	46	102.7 Å²	102.7	38%	0.38	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-38.8	175.8	0	0	0	0	0	112.5	N150 M151 E157 K158	N150-A154 PolarHBondContact O-N 2.67Å; M151-A154 PolarHBondContact O-N 3.33Å; A154-E157 PolarHBondContact O-N 3.26Å; A154-K158 WeakPolarHBondContact O-CG 3.42Å; A154-K158 PolarHBondContact O-N 3.14Å
155	L	94.3	Very high	93.8	Very high	104 Å²	104	103.3 Å²	103.3	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-38.2	174.5	-70.3	173.7	0	0	0	112.2	M151 E152 H153 K158 A159	M151-L155 HydrophobicContact CG-CD1 4.48Å; M151-L155 WeakPolarHBondContact O-CG 3.22Å; M151-L155 PolarHBondContact O-N 2.95Å; E152-L155 PolarHBondContact O-N 3.34Å; H153-L155 VanDerWaalsContact C-N 3.3Å; H153-L155 PolarHBondContact O-N 2.93Å; L155-K158 PolarHBondContact O-N 2.69Å; L155-A159 WeakPolarHBondContact O-CB 3.3Å; L155-A159 PolarHBondContact O-N 2.88Å
156	R	94.8	Very high	93.9	Very high	152 Å²	152	101 Å²	101	57%	0.574	50%	0.495	S	S	*	.	H	α-helix	trans	-63.5	-43.7	174.3	-73.3	175.9	179.7	-130.7	4.8	111.7	E152 H153 A159 K160	E152-R156 WeakPolarHBondContact O-CG 3.42Å; E152-R156 PolarHBondContact O-N 3.05Å; E152-R156 IonicContact OE1-CZ 2.85Å; E152-R156 IonicContact OE1-NE 3.64Å; E152-R156 PolarHBondContact OE1-NE 3.19Å; E152-R156 IonicContact OE1-NH2 3.22Å; E152-R156 PolarHBondContact OE1-NH2 3.15Å; H153-R156 WeakPolarHBondContact O-CB 3.43Å; H153-R156 PolarHBondContact O-N 2.99Å; H153-R156 VanDerWaalsContact O-N 3.11Å; R156-A159 PolarHBondContact O-N 2.91Å; R156-K160 WeakPolarHBondContact O-CG 3.38Å; R156-K160 PolarHBondContact O-N 2.95Å
157	E	94.9	Very high	93.9	Very high	77 Å²	77	107.4 Å²	107.4	36%	0.36	51%	0.513	S	S	.	.	H	α-helix	trans	-65.8	-41.5	176.2	-64.7	-48.4	115.4	0	0	111.9	H153 A154 A159 K160 A161	H153-E157 IonicContact CE1-OE1 3.66Å; H153-E157 PolarHBondContact O-N 3.46Å; A154-E157 PolarHBondContact O-N 3.26Å; E157-A159 VanDerWaalsContact C-N 3.35Å; E157-A159 PolarHBondContact O-N 2.82Å; E157-K160 WeakPolarHBondContact O-CB 3.4Å; E157-K160 PolarHBondContact O-N 3.13Å; E157-K160 WeakPolarHBondContact OE1-CE 3.48Å; E157-K160 IonicContact OE1-NZ 2.76Å; E157-K160 PolarHBondContact OE1-NZ 2.83Å; E157-K160 IonicContact OE2-NZ 3.99Å; E157-A161 PolarHBondContact O-N 3.27Å
158	K	93.4	Very high	93.9	Very high	135 Å²	135	104 Å²	104	59%	0.587	51%	0.507	S	S	*	.	H	α-helix	trans	-57.5	-47.9	171.2	-76.4	179.9	179.6	-175.7	0	111.3	A154 L155 K160 A161 F162	A154-K158 WeakPolarHBondContact O-CG 3.42Å; A154-K158 PolarHBondContact O-N 3.14Å; L155-K158 PolarHBondContact O-N 2.69Å; K158-K160 VanDerWaalsContact C-N 3.32Å; K158-K160 PolarHBondContact O-N 2.82Å; K158-A161 WeakPolarHBondContact O-CB 3.19Å; K158-A161 PolarHBondContact O-N 2.86Å; K158-A161 VanDerWaalsContact O-N 3.11Å; K158-F162 VanDerWaalsContact O-CD2 3.22Å; K158-F162 WeakPolarHBondContact O-CD2 3.49Å; K158-F162 PolarHBondContact O-N 3.25Å
159	A	94.3	Very high	93.9	Very high	42 Å²	42	107.1 Å²	107.1	35%	0.347	51%	0.507	S	S	.	.	H	α-helix	trans	-57.4	-45.4	177.3	0	0	0	0	0	111.3	L155 R156 E157 A161 F162 W163	L155-A159 WeakPolarHBondContact O-CB 3.3Å; L155-A159 PolarHBondContact O-N 2.88Å; R156-A159 PolarHBondContact O-N 2.91Å; E157-A159 VanDerWaalsContact C-N 3.35Å; E157-A159 PolarHBondContact O-N 2.82Å; A159-A161 VanDerWaalsContact C-N 3.31Å; A159-A161 PolarHBondContact O-N 3.12Å; A159-F162 WeakPolarHBondContact O-CB 3.43Å; A159-F162 PolarHBondContact O-N 3.48Å; A159-W163 PolarHBondContact O-N 2.77Å
160	K	95.7	Very high	93.8	Very high	120 Å²	120	105.8 Å²	105.8	52%	0.522	51%	0.506	S	S	.	.	H	α-helix	trans	-57.1	-41.6	175	-71.5	173.4	-177.3	171.9	0	112.5	R156 E157 K158 W163 A164	R156-K160 WeakPolarHBondContact O-CG 3.38Å; R156-K160 PolarHBondContact O-N 2.95Å; E157-K160 WeakPolarHBondContact O-CB 3.4Å; E157-K160 PolarHBondContact O-N 3.13Å; E157-K160 WeakPolarHBondContact OE1-CE 3.48Å; E157-K160 IonicContact OE1-NZ 2.76Å; E157-K160 PolarHBondContact OE1-NZ 2.83Å; E157-K160 IonicContact OE2-NZ 3.99Å; K158-K160 VanDerWaalsContact C-N 3.32Å; K158-K160 PolarHBondContact O-N 2.82Å; K160-W163 PolarHBondContact O-N 3.36Å; K160-A164 PolarHBondContact O-N 3.11Å
161	A	94.9	Very high	93.7	Very high	61 Å²	61	102.1 Å²	102.1	50%	0.504	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-44.1	175.9	0	0	0	0	0	112	E157 K158 A159 W163 A164 M165	E157-A161 PolarHBondContact O-N 3.27Å; K158-A161 WeakPolarHBondContact O-CB 3.19Å; K158-A161 PolarHBondContact O-N 2.86Å; K158-A161 VanDerWaalsContact O-N 3.11Å; A159-A161 VanDerWaalsContact C-N 3.31Å; A159-A161 PolarHBondContact O-N 3.12Å; A161-W163 VanDerWaalsContact C-N 3.34Å; A161-W163 PolarHBondContact O-N 2.93Å; A161-A164 PolarHBondContact O-N 3.17Å; A161-M165 PolarHBondContact O-N 2.92Å
162	F	93.3	Very high	93.7	Very high	156 Å²	156	98.7 Å²	98.7	68%	0.684	48%	0.476	S	S	*	.	H	α-helix	trans	-59.5	-42.4	173	-81.9	-79	0	0	0	112.1	K158 A159 M165 R166	K158-F162 VanDerWaalsContact O-CD2 3.22Å; K158-F162 WeakPolarHBondContact O-CD2 3.49Å; K158-F162 PolarHBondContact O-N 3.25Å; A159-F162 WeakPolarHBondContact O-CB 3.43Å; A159-F162 PolarHBondContact O-N 3.48Å; F162-M165 PolarHBondContact O-N 3.46Å; F162-R166 WeakPolarHBondContact O-CB 3.32Å; F162-R166 PolarHBondContact O-N 2.64Å
163	W	95.2	Very high	93.6	Very high	145 Å²	145	96.9 Å²	96.9	55%	0.549	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-37.3	176	-76.4	109.9	0	0	0	112.9	A159 K160 A161 R166 R167	A159-W163 PolarHBondContact O-N 2.77Å; K160-W163 PolarHBondContact O-N 3.36Å; A161-W163 VanDerWaalsContact C-N 3.34Å; A161-W163 PolarHBondContact O-N 2.93Å; W163-R166 VanDerWaalsContact CH2-NH1 3.26Å; W163-R167 WeakPolarHBondContact O-CG 3.49Å; W163-R167 PolarHBondContact O-N 2.96Å
164	A	92.7	Very high	93.6	Very high	39 Å²	39	98.5 Å²	98.5	32%	0.322	48%	0.482	S	S	.	.	H	α-helix	trans	-63.9	-47.7	173.5	0	0	0	0	0	111.1	K160 A161 R166 R167 S168	K160-A164 PolarHBondContact O-N 3.11Å; A161-A164 PolarHBondContact O-N 3.17Å; A164-R166 PolarHBondContact O-N 3.44Å; A164-R167 PolarHBondContact O-N 3.24Å; A164-S168 PolarHBondContact O-N 3.04Å; A164-S168 VanDerWaalsContact O-N 3.12Å; A164-S168 PolarHBondContact O-OG 3.09Å
165	M	91.8	Very high	93.4	Very high	106 Å²	106	99 Å²	99	52%	0.522	48%	0.477	S	S	.	.	H	α-helix	trans	-60.5	-44	177.8	-172.8	58.4	69.7	0	0	112	A161 F162 R167 S168 Y169	A161-M165 PolarHBondContact O-N 2.92Å; F162-M165 PolarHBondContact O-N 3.46Å; M165-R167 VanDerWaalsContact C-N 3.32Å; M165-R167 PolarHBondContact O-N 3.02Å; M165-S168 WeakPolarHBondContact O-CB 3.39Å; M165-S168 PolarHBondContact O-N 3.2Å; M165-S168 VanDerWaalsContact O-N 3.11Å; M165-Y169 HydrophobicContact CG-CD2 3.98Å; M165-Y169 HydrophobicContact CG-CE2 3.74Å; M165-Y169 WeakPolarHBondContact O-CD2 3.23Å; M165-Y169 PolarHBondContact O-N 2.94Å; M165-Y169 HydrophobicContact SD-CD2 4.16Å; M165-Y169 HydrophobicContact SD-CE2 3.7Å
166	R	93.8	Very high	93.4	Very high	122 Å²	122	98.4 Å²	98.4	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-42.2	177.6	-159.8	-174	80.3	-177.5	9	112.1	F162 W163 A164 S168 Y169 E170	F162-R166 WeakPolarHBondContact O-CB 3.32Å; F162-R166 PolarHBondContact O-N 2.64Å; W163-R166 VanDerWaalsContact CH2-NH1 3.26Å; A164-R166 PolarHBondContact O-N 3.44Å; R166-S168 VanDerWaalsContact C-N 3.31Å; R166-S168 PolarHBondContact O-N 3.05Å; R166-Y169 PolarHBondContact O-N 2.75Å; R166-E170 IonicContact CZ-OE1 3.93Å; R166-E170 IonicContact NE-OE1 2.74Å; R166-E170 PolarHBondContact NE-OE1 3.35Å; R166-E170 IonicContact NH2-OE1 2.74Å; R166-E170 PolarHBondContact NH2-OE1 3.33Å; R166-E170 VanDerWaalsContact NH2-OE1 3.17Å; R166-E170 WeakPolarHBondContact O-CG 3.43Å; R166-E170 PolarHBondContact O-N 3.36Å
167	R	92.8	Very high	93.4	Very high	161 Å²	161	97.9 Å²	97.9	61%	0.608	48%	0.478	S	S	*	.	H	α-helix	trans	-61.8	-37.8	174.9	-75.6	-175.1	-67.8	158.5	-0.2	112.3	W163 A164 M165 E170 A171	W163-R167 WeakPolarHBondContact O-CG 3.49Å; W163-R167 PolarHBondContact O-N 2.96Å; A164-R167 PolarHBondContact O-N 3.24Å; M165-R167 VanDerWaalsContact C-N 3.32Å; M165-R167 PolarHBondContact O-N 3.02Å; R167-E170 PolarHBondContact O-N 2.74Å; R167-A171 WeakPolarHBondContact O-CB 3.39Å; R167-A171 PolarHBondContact O-N 3.17Å
168	S	90.9	Very high	93.3	Very high	64 Å²	64	98.5 Å²	98.5	45%	0.448	49%	0.487	S	S	.	.	H	α-helix	trans	-61.3	-45.6	173.9	-56.1	0	0	0	0	111.5	A164 M165 R166 A171 I172	A164-S168 PolarHBondContact O-N 3.04Å; A164-S168 VanDerWaalsContact O-N 3.12Å; A164-S168 PolarHBondContact O-OG 3.09Å; M165-S168 WeakPolarHBondContact O-CB 3.39Å; M165-S168 PolarHBondContact O-N 3.2Å; M165-S168 VanDerWaalsContact O-N 3.11Å; R166-S168 VanDerWaalsContact C-N 3.31Å; R166-S168 PolarHBondContact O-N 3.05Å; S168-A171 WeakPolarHBondContact O-CB 3.5Å; S168-A171 PolarHBondContact O-N 3.33Å; S168-I172 WeakPolarHBondContact O-CG1 3.45Å; S168-I172 PolarHBondContact O-N 3.21Å
169	Y	92.1	Very high	93.2	Very high	151 Å²	151	95.9 Å²	95.9	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-65.5	-38.7	175.5	-79.7	-74	0	0	0	113.4	M165 R166 A171 I172 A173	M165-Y169 HydrophobicContact CG-CD2 3.98Å; M165-Y169 HydrophobicContact CG-CE2 3.74Å; M165-Y169 WeakPolarHBondContact O-CD2 3.23Å; M165-Y169 PolarHBondContact O-N 2.94Å; M165-Y169 HydrophobicContact SD-CD2 4.16Å; M165-Y169 HydrophobicContact SD-CE2 3.7Å; R166-Y169 PolarHBondContact O-N 2.75Å; Y169-A171 VanDerWaalsContact C-N 3.3Å; Y169-A171 PolarHBondContact O-N 2.83Å; Y169-I172 HydrophobicContact CD1-CD1 4.44Å; Y169-I172 PolarHBondContact O-N 3.31Å; Y169-A173 WeakPolarHBondContact O-CB 3.36Å; Y169-A173 PolarHBondContact O-N 3.45Å
170	E	93.8	Very high	93.3	Very high	94 Å²	94	96.6 Å²	96.6	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-40.6	173.4	-72.5	166	-169	0	0	111	R166 R167 K174	R166-E170 IonicContact CZ-OE1 3.93Å; R166-E170 IonicContact NE-OE1 2.74Å; R166-E170 PolarHBondContact NE-OE1 3.35Å; R166-E170 IonicContact NH2-OE1 2.74Å; R166-E170 PolarHBondContact NH2-OE1 3.33Å; R166-E170 VanDerWaalsContact NH2-OE1 3.17Å; R166-E170 WeakPolarHBondContact O-CG 3.43Å; R166-E170 PolarHBondContact O-N 3.36Å; R167-E170 PolarHBondContact O-N 2.74Å; E170-K174 PolarHBondContact O-N 2.94Å; E170-K174 VanDerWaalsContact O-N 3.08Å
171	A	91.6	Very high	93.3	Very high	43 Å²	43	93.9 Å²	93.9	36%	0.355	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-44.7	175.1	0	0	0	0	0	112.3	R167 S168 Y169 K174 H175 V333	R167-A171 WeakPolarHBondContact O-CB 3.39Å; R167-A171 PolarHBondContact O-N 3.17Å; S168-A171 WeakPolarHBondContact O-CB 3.5Å; S168-A171 PolarHBondContact O-N 3.33Å; Y169-A171 VanDerWaalsContact C-N 3.3Å; Y169-A171 PolarHBondContact O-N 2.83Å; A171-K174 PolarHBondContact O-N 3.1Å; A171-H175 WeakPolarHBondContact O-CB 3.25Å; A171-H175 PolarHBondContact O-N 3.29Å; A171-V333 HydrophobicContact CB-CG2 4.25Å
172	I	92.3	Very high	93.2	Very high	53 Å²	53	95.9 Å²	95.9	27%	0.272	48%	0.477	S	S	.	.	H	α-helix	trans	-58.6	-48.3	174.7	-67.6	163.5	0	0	0	110.6	S168 Y169 K174 H175 N176 V333	S168-I172 WeakPolarHBondContact O-CG1 3.45Å; S168-I172 PolarHBondContact O-N 3.21Å; Y169-I172 HydrophobicContact CD1-CD1 4.44Å; Y169-I172 PolarHBondContact O-N 3.31Å; I172-K174 VanDerWaalsContact C-N 3.32Å; I172-K174 PolarHBondContact O-N 2.9Å; I172-H175 PolarHBondContact O-N 3.22Å; I172-N176 WeakPolarHBondContact O-CB 3.5Å; I172-N176 VanDerWaalsContact O-CG 3.28Å; I172-N176 PolarHBondContact O-N 3.03Å; I172-N176 PolarHBondContact O-OD1 2.96Å; I172-V333 HydrophobicContact CB-CG1 4.25Å; I172-V333 HydrophobicContact CG1-CG1 3.38Å
173	A	94.4	Very high	93.3	Very high	50 Å²	50	92.7 Å²	92.7	41%	0.413	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-44.1	180	0	0	0	0	0	111.7	Y169 Q177	Y169-A173 WeakPolarHBondContact O-CB 3.36Å; Y169-A173 PolarHBondContact O-N 3.45Å; A173-Q177 WeakPolarHBondContact O-CG 3.24Å; A173-Q177 PolarHBondContact O-N 3.3Å; A173-Q177 VanDerWaalsContact O-N 3.15Å
174	K	93.9	Very high	93.4	Very high	148 Å²	148	90.3 Å²	90.3	64%	0.643	46%	0.461	S	S	*	.	H	α-helix	trans	-65.1	-42.7	176.9	-173.7	177.7	-179.8	-179.1	0	112.1	E170 A171 I172 Q177 V178	E170-K174 PolarHBondContact O-N 2.94Å; E170-K174 VanDerWaalsContact O-N 3.08Å; A171-K174 PolarHBondContact O-N 3.1Å; I172-K174 VanDerWaalsContact C-N 3.32Å; I172-K174 PolarHBondContact O-N 2.9Å; K174-Q177 PolarHBondContact O-N 2.86Å; K174-V178 WeakPolarHBondContact O-CG2 3.47Å; K174-V178 PolarHBondContact O-N 3.11Å
175	H	91.3	Very high	93.6	Very high	57 Å²	57	90.1 Å²	90.1	26%	0.264	46%	0.463	S	S	.	.	H	α-helix	trans	-61.8	-49.3	176.6	171.8	65.8	0	0	0	111.4	A171 I172 Q177 V178 E179 V333	A171-H175 WeakPolarHBondContact O-CB 3.25Å; A171-H175 PolarHBondContact O-N 3.29Å; I172-H175 PolarHBondContact O-N 3.22Å; H175-Q177 PolarHBondContact O-N 3.33Å; H175-V178 PolarHBondContact O-N 2.85Å; H175-E179 IonicContact CE1-OE2 3.39Å; H175-E179 PolarHBondContact CE1-OE2 2.97Å; H175-E179 WeakPolarHBondContact O-CB 3.29Å; H175-E179 PolarHBondContact O-N 3.31Å; H175-V333 HydrophobicContact CB-CB 4.23Å; H175-V333 HydrophobicContact CB-CG2 3.47Å; H175-V333 VanDerWaalsContact CB-CG2 3.47Å
176	N	93	Very high	93.7	Very high	91 Å²	91	87.9 Å²	87.9	49%	0.487	45%	0.449	S	S	.	.	H	α-helix	trans	-58.1	-35.5	178.6	-70.1	0.2	0	0	0	112.5	I172 A180	I172-N176 WeakPolarHBondContact O-CB 3.5Å; I172-N176 VanDerWaalsContact O-CG 3.28Å; I172-N176 PolarHBondContact O-N 3.03Å; I172-N176 PolarHBondContact O-OD1 2.96Å; N176-A180 WeakPolarHBondContact O-CB 3.33Å; N176-A180 PolarHBondContact O-N 2.96Å
177	Q	95.2	Very high	93.8	Very high	140 Å²	140	86.2 Å²	86.2	65%	0.654	45%	0.448	S	S	*	.	H	α-helix	trans	-64.9	-45.9	174.7	-74.5	174	1.8	0	0	112.4	A173 K174 H175 A181	A173-Q177 WeakPolarHBondContact O-CG 3.24Å; A173-Q177 PolarHBondContact O-N 3.3Å; A173-Q177 VanDerWaalsContact O-N 3.15Å; K174-Q177 PolarHBondContact O-N 2.86Å; H175-Q177 PolarHBondContact O-N 3.33Å; Q177-A181 PolarHBondContact O-N 2.87Å
178	V	92.6	Very high	94	Very high	91 Å²	91	85.3 Å²	85.3	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-65.6	-45.4	178	174.6	0	0	0	0	110.5	K174 H175 A181 W182	K174-V178 WeakPolarHBondContact O-CG2 3.47Å; K174-V178 PolarHBondContact O-N 3.11Å; H175-V178 PolarHBondContact O-N 2.85Å; V178-A181 PolarHBondContact O-N 2.77Å; V178-W182 WeakPolarHBondContact O-CB 3.44Å; V178-W182 PolarHBondContact O-N 3.06Å
179	E	91.6	Very high	94.2	Very high	80 Å²	80	86.4 Å²	86.4	37%	0.374	44%	0.443	S	S	.	.	H	α-helix	trans	-64.5	-41.6	-179.1	-154.1	73.8	177.7	0	0	111.4	H175 W182 L183	H175-E179 IonicContact CE1-OE2 3.39Å; H175-E179 PolarHBondContact CE1-OE2 2.97Å; H175-E179 WeakPolarHBondContact O-CB 3.29Å; H175-E179 PolarHBondContact O-N 3.31Å; E179-W182 PolarHBondContact O-N 2.92Å; E179-L183 VanDerWaalsContact O-CB 3.25Å; E179-L183 WeakPolarHBondContact O-CB 3.2Å; E179-L183 PolarHBondContact O-N 3.17Å
180	A	95.5	Very high	94.3	Very high	57 Å²	57	83.2 Å²	83.2	47%	0.471	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-45.5	176.8	0	0	0	0	0	112.1	N176 W182 L183 E184	N176-A180 WeakPolarHBondContact O-CB 3.33Å; N176-A180 PolarHBondContact O-N 2.96Å; A180-W182 VanDerWaalsContact C-N 3.34Å; A180-W182 PolarHBondContact O-N 2.96Å; A180-L183 PolarHBondContact O-N 3.42Å; A180-E184 WeakPolarHBondContact O-CB 3.26Å; A180-E184 PolarHBondContact O-N 3.08Å
181	A	96	Very high	94.4	Very high	62 Å²	62	84.1 Å²	84.1	51%	0.512	44%	0.436	S	S	.	.	H	α-helix	trans	-64.3	-40.2	177.7	0	0	0	0	0	111.9	Q177 V178 G185	Q177-A181 PolarHBondContact O-N 2.87Å; V178-A181 PolarHBondContact O-N 2.77Å; A181-G185 PolarHBondContact O-N 2.71Å
182	W	93.3	Very high	94.6	Very high	104 Å²	104	85.9 Å²	85.9	39%	0.394	44%	0.439	S	S	.	.	H	α-helix	trans	-63.5	-48.7	174.4	176.9	87.8	0	0	0	111.5	V178 E179 A180 E184 G185 R186 D319	V178-W182 WeakPolarHBondContact O-CB 3.44Å; V178-W182 PolarHBondContact O-N 3.06Å; E179-W182 PolarHBondContact O-N 2.92Å; A180-W182 VanDerWaalsContact C-N 3.34Å; A180-W182 PolarHBondContact O-N 2.96Å; W182-E184 PolarHBondContact O-N 3.49Å; W182-G185 PolarHBondContact O-N 3.09Å; W182-G185 VanDerWaalsContact O-N 3.12Å; W182-R186 HydrophobicContact CD2-CG 3.93Å; W182-R186 HydrophobicContact CE3-CG 4.19Å; W182-R186 HydrophobicContact CH2-CG 3.9Å; W182-R186 HydrophobicContact CZ2-CG 3.63Å; W182-R186 HydrophobicContact CZ3-CG 4.17Å; W182-R186 WeakPolarHBondContact O-CG 3.46Å; W182-R186 PolarHBondContact O-N 2.77Å; W182-D319 HydrophobicContact CH2-CB 4.46Å; W182-D319 HydrophobicContact CZ2-CB 4.07Å
183	L	94.6	Very high	94.7	Very high	89 Å²	89	88.6 Å²	88.6	47%	0.466	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-43.5	179.7	178.5	61	0	0	0	111.8	E179 A180 G185 R186 I187	E179-L183 VanDerWaalsContact O-CB 3.25Å; E179-L183 WeakPolarHBondContact O-CB 3.2Å; E179-L183 PolarHBondContact O-N 3.17Å; A180-L183 PolarHBondContact O-N 3.42Å; L183-G185 VanDerWaalsContact C-N 3.3Å; L183-G185 PolarHBondContact O-N 3.32Å; L183-R186 PolarHBondContact O-N 2.65Å; L183-I187 HydrophobicContact CD1-CD1 4.04Å; L183-I187 HydrophobicContact CD1-CG1 4.17Å; L183-I187 HydrophobicContact CG-CD1 3.89Å; L183-I187 HydrophobicContact CG-CG1 4.44Å; L183-I187 VanDerWaalsContact O-CG1 3.32Å; L183-I187 WeakPolarHBondContact O-CG1 3.49Å; L183-I187 PolarHBondContact O-N 2.91Å
184	E	97.3	Very high	94.7	Very high	94 Å²	94	89.4 Å²	89.4	44%	0.439	45%	0.446	S	S	.	.	H	α-helix	trans	-57.6	-43.5	174.9	-172.7	-173.6	153.5	0	0	111.5	A180 W182 R188	A180-E184 WeakPolarHBondContact O-CB 3.26Å; A180-E184 PolarHBondContact O-N 3.08Å; W182-E184 PolarHBondContact O-N 3.49Å; E184-R188 WeakPolarHBondContact O-CG 3.33Å; E184-R188 PolarHBondContact O-N 3.44Å; E184-R188 VanDerWaalsContact O-N 3.12Å; E184-R188 IonicContact OE1-CZ 3.89Å; E184-R188 IonicContact OE1-NH1 3.27Å; E184-R188 PolarHBondContact OE1-NH1 2.79Å; E184-R188 IonicContact OE1-NH2 2.94Å; E184-R188 PolarHBondContact OE1-NH2 3.2Å
185	G	96.9	Very high	94.8	Very high	35 Å²	35	88.5 Å²	88.5	36%	0.361	44%	0.439	S	S	.	.	H	α-helix	trans	-62.2	-44.3	174.5	0	0	0	0	0	113.1	A181 W182 L183 R188 Q189	A181-G185 PolarHBondContact O-N 2.71Å; W182-G185 PolarHBondContact O-N 3.09Å; W182-G185 VanDerWaalsContact O-N 3.12Å; L183-G185 VanDerWaalsContact C-N 3.3Å; L183-G185 PolarHBondContact O-N 3.32Å; G185-R188 PolarHBondContact O-N 2.87Å; G185-Q189 PolarHBondContact O-N 2.86Å
186	R	94.2	Very high	95.1	Very high	60 Å²	60	90.5 Å²	90.5	23%	0.226	45%	0.448	C	S	.	.	H	α-helix	trans	-66.1	-43.8	178.6	-63.5	-57.5	-77.8	-175.4	-15.1	112.3	W182 L183 R188 Q189 E190 D319	W182-R186 HydrophobicContact CD2-CG 3.93Å; W182-R186 HydrophobicContact CE3-CG 4.19Å; W182-R186 HydrophobicContact CH2-CG 3.9Å; W182-R186 HydrophobicContact CZ2-CG 3.63Å; W182-R186 HydrophobicContact CZ3-CG 4.17Å; W182-R186 WeakPolarHBondContact O-CG 3.46Å; W182-R186 PolarHBondContact O-N 2.77Å; L183-R186 PolarHBondContact O-N 2.65Å; R186-R188 VanDerWaalsContact C-N 3.3Å; R186-R188 PolarHBondContact O-N 2.95Å; R186-Q189 WeakPolarHBondContact O-CB 3.48Å; R186-Q189 PolarHBondContact O-N 2.79Å; R186-Q189 VanDerWaalsContact O-N 3.13Å; R186-E190 PolarHBondContact O-N 3.28Å; R186-D319 IonicContact CZ-OD2 2.69Å; R186-D319 IonicContact NE-OD2 3.76Å; R186-D319 IonicContact NH1-OD2 3.79Å; R186-D319 IonicContact NH2-OD2 2.82Å; R186-D319 PolarHBondContact NH2-OD2 3.18Å
187	I	95.5	Very high	95.3	Very high	86 Å²	86	88 Å²	88	44%	0.441	43%	0.433	S	S	.	.	H	α-helix	trans	-57.1	-47.5	175.5	-69	168.1	0	0	0	109.8	L183 Q189 E190 F191	L183-I187 HydrophobicContact CD1-CD1 4.04Å; L183-I187 HydrophobicContact CD1-CG1 4.17Å; L183-I187 HydrophobicContact CG-CD1 3.89Å; L183-I187 HydrophobicContact CG-CG1 4.44Å; L183-I187 VanDerWaalsContact O-CG1 3.32Å; L183-I187 WeakPolarHBondContact O-CG1 3.49Å; L183-I187 PolarHBondContact O-N 2.91Å; I187-Q189 VanDerWaalsContact C-N 3.32Å; I187-Q189 PolarHBondContact O-N 3.49Å; I187-E190 PolarHBondContact O-N 3.26Å; I187-F191 HydrophobicContact CG2-CD2 4.02Å; I187-F191 HydrophobicContact CG2-CE2 4.09Å; I187-F191 WeakPolarHBondContact O-CD2 3.47Å; I187-F191 PolarHBondContact O-N 2.94Å; I187-F191 VanDerWaalsContact O-N 3.12Å
188	R	97.6	Very high	95.3	Very high	142 Å²	142	85.2 Å²	85.2	54%	0.536	42%	0.422	S	S	.	.	H	α-helix	trans	-57.5	-45.7	176	-74.7	179.9	177.2	128.1	4.7	112.2	E184 G185 R186 E190 F191 D192	E184-R188 WeakPolarHBondContact O-CG 3.33Å; E184-R188 PolarHBondContact O-N 3.44Å; E184-R188 VanDerWaalsContact O-N 3.12Å; E184-R188 IonicContact OE1-CZ 3.89Å; E184-R188 IonicContact OE1-NH1 3.27Å; E184-R188 PolarHBondContact OE1-NH1 2.79Å; E184-R188 IonicContact OE1-NH2 2.94Å; E184-R188 PolarHBondContact OE1-NH2 3.2Å; G185-R188 PolarHBondContact O-N 2.87Å; R186-R188 VanDerWaalsContact C-N 3.3Å; R186-R188 PolarHBondContact O-N 2.95Å; R188-E190 PolarHBondContact O-N 3.26Å; R188-F191 PolarHBondContact O-N 3.28Å; R188-D192 VanDerWaalsContact O-CG 3.29Å; R188-D192 PolarHBondContact O-N 2.82Å
189	Q	95.7	Very high	95.6	Very high	87 Å²	87	88.1 Å²	88.1	41%	0.407	42%	0.424	S	S	.	.	H	α-helix	trans	-60.1	-43.2	-180	-172.9	178	8.5	0	0	112.5	G185 R186 I187 D192 K193	G185-Q189 PolarHBondContact O-N 2.86Å; R186-Q189 WeakPolarHBondContact O-CB 3.48Å; R186-Q189 PolarHBondContact O-N 2.79Å; R186-Q189 VanDerWaalsContact O-N 3.13Å; I187-Q189 VanDerWaalsContact C-N 3.32Å; I187-Q189 PolarHBondContact O-N 3.49Å; Q189-D192 PolarHBondContact O-N 2.84Å; Q189-K193 WeakPolarHBondContact O-CG 3.45Å; Q189-K193 PolarHBondContact O-N 2.98Å; Q189-K193 VanDerWaalsContact O-N 3.12Å
190	E	93.4	Very high	95.8	Very high	84 Å²	84	88.2 Å²	88.2	39%	0.393	43%	0.429	S	S	.	.	H	α-helix	trans	-64.6	-40.1	176.5	-64.1	-49.3	131.7	0	0	111.9	R186 I187 R188 D192 K193 L194	R186-E190 PolarHBondContact O-N 3.28Å; I187-E190 PolarHBondContact O-N 3.26Å; R188-E190 PolarHBondContact O-N 3.26Å; E190-D192 VanDerWaalsContact C-N 3.35Å; E190-D192 PolarHBondContact O-N 3.49Å; E190-K193 PolarHBondContact O-N 2.9Å; E190-K193 IonicContact OE1-NZ 3Å; E190-K193 PolarHBondContact OE1-NZ 3.27Å; E190-K193 IonicContact OE2-NZ 3.18Å; E190-K193 PolarHBondContact OE2-NZ 3.47Å; E190-L194 PolarHBondContact O-N 3.45Å
191	F	95.8	Very high	95.9	Very high	114 Å²	114	86.9 Å²	86.9	50%	0.5	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-36.3	174.1	-89.1	-95.4	0	0	0	112.9	I187 R188 K193 L194 R195	I187-F191 HydrophobicContact CG2-CD2 4.02Å; I187-F191 HydrophobicContact CG2-CE2 4.09Å; I187-F191 WeakPolarHBondContact O-CD2 3.47Å; I187-F191 PolarHBondContact O-N 2.94Å; I187-F191 VanDerWaalsContact O-N 3.12Å; R188-F191 PolarHBondContact O-N 3.28Å; F191-K193 VanDerWaalsContact C-N 3.34Å; F191-L194 PolarHBondContact O-N 2.95Å; F191-R195 WeakPolarHBondContact O-CG 3.26Å; F191-R195 PolarHBondContact O-N 3.13Å
192	D	96.6	Very high	96	Very high	79 Å²	79	90 Å²	90	42%	0.422	42%	0.417	S	S	.	.	H	α-helix	trans	-67.8	-34	178.4	-71.8	-23.5	0	0	0	111.9	R188 Q189 E190 L194 R195 E196	R188-D192 VanDerWaalsContact O-CG 3.29Å; R188-D192 PolarHBondContact O-N 2.82Å; Q189-D192 PolarHBondContact O-N 2.84Å; E190-D192 VanDerWaalsContact C-N 3.35Å; E190-D192 PolarHBondContact O-N 3.49Å; D192-L194 VanDerWaalsContact C-N 3.34Å; D192-L194 PolarHBondContact O-N 3.21Å; D192-R195 PolarHBondContact O-N 2.97Å; D192-R195 IonicContact OD1-CZ 3.4Å; D192-R195 IonicContact OD1-NH1 3.63Å; D192-R195 PolarHBondContact OD1-NH1 2.86Å; D192-E196 WeakPolarHBondContact O-CB 3.37Å; D192-E196 PolarHBondContact O-N 3.31Å
193	K	93.9	Very high	96.2	Very high	110 Å²	110	89.9 Å²	89.9	48%	0.478	42%	0.421	S	S	.	.	H	α-helix	trans	-58.8	-44.6	170.4	-66.7	174	-168.3	167.4	0	111.9	Q189 E190 F191 E196 F197	Q189-K193 WeakPolarHBondContact O-CG 3.45Å; Q189-K193 PolarHBondContact O-N 2.98Å; Q189-K193 VanDerWaalsContact O-N 3.12Å; E190-K193 PolarHBondContact O-N 2.9Å; E190-K193 IonicContact OE1-NZ 3Å; E190-K193 PolarHBondContact OE1-NZ 3.27Å; E190-K193 IonicContact OE2-NZ 3.18Å; E190-K193 PolarHBondContact OE2-NZ 3.47Å; F191-K193 VanDerWaalsContact C-N 3.34Å; K193-E196 PolarHBondContact O-N 3.14Å; K193-F197 PolarHBondContact O-N 3.4Å
194	L	95.3	Very high	96.4	Very high	68 Å²	68	88.1 Å²	88.1	36%	0.356	42%	0.419	S	S	.	.	H	α-helix	trans	-67.2	-40.7	178.8	-61.7	178.4	0	0	0	112	E190 F191 D192 F197 L198 M295 V299	E190-L194 PolarHBondContact O-N 3.45Å; F191-L194 PolarHBondContact O-N 2.95Å; D192-L194 VanDerWaalsContact C-N 3.34Å; D192-L194 PolarHBondContact O-N 3.21Å; L194-F197 PolarHBondContact O-N 2.79Å; L194-L198 WeakPolarHBondContact O-CG 3.25Å; L194-L198 PolarHBondContact O-N 3.06Å; L194-M295 HydrophobicContact CD2-CG 4.43Å; L194-M295 HydrophobicContact CD2-SD 4.13Å; L194-V299 HydrophobicContact CD2-CG2 4.14Å
195	R	96.5	Very high	96.4	Very high	129 Å²	129	85.4 Å²	85.4	49%	0.487	41%	0.407	S	S	.	.	H	α-helix	trans	-63.7	-42.1	175.5	-71.6	168.9	-178.7	162	-2.4	111.8	F191 D192 L198 R199	F191-R195 WeakPolarHBondContact O-CG 3.26Å; F191-R195 PolarHBondContact O-N 3.13Å; D192-R195 PolarHBondContact O-N 2.97Å; D192-R195 IonicContact OD1-CZ 3.4Å; D192-R195 IonicContact OD1-NH1 3.63Å; D192-R195 PolarHBondContact OD1-NH1 2.86Å; R195-L198 PolarHBondContact O-N 3.47Å; R195-R199 WeakPolarHBondContact O-CG 3.45Å; R195-R199 PolarHBondContact O-N 3Å
196	E	96.3	Very high	96.4	Very high	99 Å²	99	87.7 Å²	87.7	46%	0.463	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-43.5	178.4	-171.5	58	-160.1	0	0	111.2	D192 K193 L198 R199 V200	D192-E196 WeakPolarHBondContact O-CB 3.37Å; D192-E196 PolarHBondContact O-N 3.31Å; K193-E196 PolarHBondContact O-N 3.14Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 2.97Å; E196-R199 PolarHBondContact O-N 3.47Å; E196-R199 IonicContact OE2-NH1 3.14Å; E196-V200 WeakPolarHBondContact O-CG2 3.31Å; E196-V200 PolarHBondContact O-N 2.96Å
197	F	96.9	Very high	96.6	Very high	38 Å²	38	89.1 Å²	89.1	17%	0.167	42%	0.423	C	S	.	.	H	α-helix	trans	-53.5	-48.3	171.6	173.5	-87.8	0	0	0	111.8	K193 L194 R199 V200 E201 V291 K294 M295	K193-F197 PolarHBondContact O-N 3.4Å; L194-F197 PolarHBondContact O-N 2.79Å; F197-R199 PolarHBondContact O-N 2.89Å; F197-V200 PolarHBondContact O-N 3.35Å; F197-E201 HydrophobicContact CD1-CG 4.38Å; F197-E201 HydrophobicContact CE1-CG 3.8Å; F197-E201 HydrophobicContact CE2-CG 4.07Å; F197-E201 HydrophobicContact CZ-CG 3.62Å; F197-E201 PolarHBondContact O-N 3.28Å; F197-V291 HydrophobicContact CE1-CG1 4.12Å; F197-K294 HydrophobicContact CZ-CB 3.95Å; F197-M295 HydrophobicContact CD1-CB 4.05Å; F197-M295 HydrophobicContact CD1-CE 3.96Å; F197-M295 HydrophobicContact CD1-CG 3.76Å; F197-M295 HydrophobicContact CD1-SD 4.48Å; F197-M295 HydrophobicContact CE1-CB 3.47Å; F197-M295 VanDerWaalsContact CE1-CB 3.47Å; F197-M295 HydrophobicContact CE1-CE 3.97Å; F197-M295 HydrophobicContact CE1-CG 3.74Å; F197-M295 HydrophobicContact CG-CG 4.38Å; F197-M295 VanDerWaalsContact CZ-CA 3.44Å; F197-M295 HydrophobicContact CZ-CB 3.82Å; F197-M295 HydrophobicContact CZ-CG 4.33Å
198	L	96.7	Very high	96.7	Very high	81 Å²	81	87.3 Å²	87.3	42%	0.424	42%	0.421	S	S	.	.	H	α-helix	trans	-62.6	-41.1	179.5	-73.3	172.9	0	0	0	112.5	L194 R195 E196 E201 E202 V291 M295	L194-L198 WeakPolarHBondContact O-CG 3.25Å; L194-L198 PolarHBondContact O-N 3.06Å; R195-L198 PolarHBondContact O-N 3.47Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 2.97Å; L198-E201 PolarHBondContact O-N 3.33Å; L198-E202 VanDerWaalsContact O-CB 3.3Å; L198-E202 WeakPolarHBondContact O-CB 3.41Å; L198-E202 PolarHBondContact O-N 3.45Å; L198-V291 HydrophobicContact CD2-CG1 3.77Å; L198-M295 HydrophobicContact CD2-CE 3.53Å; L198-M295 HydrophobicContact CG-CE 4.03Å
199	R	97.8	Very high	96.7	Very high	153 Å²	153	83.8 Å²	83.8	58%	0.577	41%	0.411	S	S	*	.	H	α-helix	trans	-63.1	-44.4	176.1	-74.6	176.2	179.9	156.4	-1.3	112	R195 E196 F197 E202 Q203	R195-R199 WeakPolarHBondContact O-CG 3.45Å; R195-R199 PolarHBondContact O-N 3Å; E196-R199 PolarHBondContact O-N 3.47Å; E196-R199 IonicContact OE2-NH1 3.14Å; F197-R199 PolarHBondContact O-N 2.89Å; R199-E202 PolarHBondContact O-N 2.77Å; R199-Q203 WeakPolarHBondContact O-CB 3.34Å; R199-Q203 PolarHBondContact O-N 2.98Å
200	V	97.2	Very high	96.9	Very high	81 Å²	81	82.2 Å²	82.2	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-63.8	-44.7	178.9	171.2	0	0	0	0	110.8	E196 F197 Q203 A204	E196-V200 WeakPolarHBondContact O-CG2 3.31Å; E196-V200 PolarHBondContact O-N 2.96Å; F197-V200 PolarHBondContact O-N 3.35Å; V200-Q203 PolarHBondContact O-N 3.09Å; V200-A204 WeakPolarHBondContact O-CB 3.26Å; V200-A204 PolarHBondContact O-N 2.8Å
201	E	96.9	Very high	97.1	Very high	30 Å²	30	81.6 Å²	81.6	14%	0.14	41%	0.41	C	S	.	.	H	α-helix	trans	-66.9	-40.6	177.3	-77.1	-70.7	139.5	0	0	112.5	F197 L198 A204 I205 V291 K294	F197-E201 HydrophobicContact CD1-CG 4.38Å; F197-E201 HydrophobicContact CE1-CG 3.8Å; F197-E201 HydrophobicContact CE2-CG 4.07Å; F197-E201 HydrophobicContact CZ-CG 3.62Å; F197-E201 PolarHBondContact O-N 3.28Å; L198-E201 PolarHBondContact O-N 3.33Å; E201-A204 PolarHBondContact O-N 2.74Å; E201-I205 VanDerWaalsContact O-CG1 3.24Å; E201-I205 WeakPolarHBondContact O-CG1 3.12Å; E201-I205 PolarHBondContact O-N 2.94Å; E201-I205 VanDerWaalsContact O-N 3.1Å; E201-V291 HydrophobicContact CB-CG1 4.36Å; E201-K294 IonicContact OE1-NZ 3.76Å; E201-K294 PolarHBondContact OE1-NZ 3Å; E201-K294 VanDerWaalsContact OE2-CD 3.22Å; E201-K294 WeakPolarHBondContact OE2-CD 3.46Å; E201-K294 IonicContact OE2-NZ 3.3Å; E201-K294 PolarHBondContact OE2-NZ 3.04Å
202	E	97.7	Very high	97.2	Very high	128 Å²	128	77 Å²	77	60%	0.598	39%	0.39	S	S	*	.	H	α-helix	trans	-57.9	-51	173.8	177.1	176.8	-142.6	0	0	110.9	L198 R199 A204 I205 L206	L198-E202 VanDerWaalsContact O-CB 3.3Å; L198-E202 WeakPolarHBondContact O-CB 3.41Å; L198-E202 PolarHBondContact O-N 3.45Å; R199-E202 PolarHBondContact O-N 2.77Å; E202-A204 PolarHBondContact O-N 2.74Å; E202-I205 PolarHBondContact O-N 3.47Å; E202-L206 HydrophobicContact CG-CD1 4.11Å; E202-L206 WeakPolarHBondContact O-CG 3.24Å; E202-L206 PolarHBondContact O-N 2.91Å
203	Q	98.3	Very high	97.2	Very high	101 Å²	101	75.7 Å²	75.7	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-62.7	-43.7	-179.8	-170.7	61.6	51.6	0	0	111.7	R199 V200 I205 L206 D207	R199-Q203 WeakPolarHBondContact O-CB 3.34Å; R199-Q203 PolarHBondContact O-N 2.98Å; V200-Q203 PolarHBondContact O-N 3.09Å; Q203-I205 VanDerWaalsContact C-N 3.27Å; Q203-I205 PolarHBondContact O-N 3.08Å; Q203-L206 PolarHBondContact O-N 2.95Å; Q203-D207 PolarHBondContact NE2-OD1 3.22Å; Q203-D207 WeakPolarHBondContact O-CB 3.43Å; Q203-D207 VanDerWaalsContact O-CG 3.23Å; Q203-D207 PolarHBondContact O-N 2.88Å
204	A	97.6	Very high	97.4	Very high	51 Å²	51	76.5 Å²	76.5	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-60.3	-37.2	178.6	0	0	0	0	0	112.6	V200 E201 E202 A208	V200-A204 WeakPolarHBondContact O-CB 3.26Å; V200-A204 PolarHBondContact O-N 2.8Å; E201-A204 PolarHBondContact O-N 2.74Å; E202-A204 PolarHBondContact O-N 2.74Å; A204-A208 WeakPolarHBondContact O-CB 3.41Å; A204-A208 PolarHBondContact O-N 3.49Å; A204-A208 VanDerWaalsContact O-N 3.11Å
205	I	97.2	Very high	97.5	Very high	38 Å²	38	77.7 Å²	77.7	20%	0.195	39%	0.389	C	S	.	.	H	α-helix	trans	-70.7	-43	177	-68.2	171.4	0	0	0	110.9	E201 E202 Q203 A208 M209 Y283 L287 V291	E201-I205 VanDerWaalsContact O-CG1 3.24Å; E201-I205 WeakPolarHBondContact O-CG1 3.12Å; E201-I205 PolarHBondContact O-N 2.94Å; E201-I205 VanDerWaalsContact O-N 3.1Å; E202-I205 PolarHBondContact O-N 3.47Å; Q203-I205 VanDerWaalsContact C-N 3.27Å; Q203-I205 PolarHBondContact O-N 3.08Å; I205-A208 PolarHBondContact O-N 3.32Å; I205-M209 PolarHBondContact O-N 2.98Å; I205-Y283 HydrophobicContact CG2-CD1 4.12Å; I205-L287 HydrophobicContact CD1-CD1 3.46Å; I205-L287 VanDerWaalsContact CD1-CD1 3.46Å; I205-V291 HydrophobicContact CD1-CG2 4.14Å
206	L	98	Very high	97.5	Very high	82 Å²	82	74.1 Å²	74.1	43%	0.429	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-43.3	176.7	-70.5	174.3	0	0	0	111.9	E202 Q203 M209 A210	E202-L206 HydrophobicContact CG-CD1 4.11Å; E202-L206 WeakPolarHBondContact O-CG 3.24Å; E202-L206 PolarHBondContact O-N 2.91Å; Q203-L206 PolarHBondContact O-N 2.95Å; L206-M209 PolarHBondContact O-N 3.08Å; L206-A210 WeakPolarHBondContact O-CB 3.41Å; L206-A210 PolarHBondContact O-N 3.34Å
207	D	98.4	Very high	97.5	Very high	90 Å²	90	74.4 Å²	74.4	48%	0.481	38%	0.379	S	S	.	.	H	α-helix	trans	-62.9	-43.8	177.6	-69.7	-17.3	0	0	0	111.3	Q203 M209 A210 E211	Q203-D207 PolarHBondContact NE2-OD1 3.22Å; Q203-D207 WeakPolarHBondContact O-CB 3.43Å; Q203-D207 VanDerWaalsContact O-CG 3.23Å; Q203-D207 PolarHBondContact O-N 2.88Å; D207-M209 VanDerWaalsContact C-N 3.26Å; D207-M209 PolarHBondContact O-N 2.91Å; D207-A210 PolarHBondContact O-N 3.12Å; D207-E211 PolarHBondContact O-N 3.22Å
208	A	97.6	Very high	97.5	Very high	49 Å²	49	77.1 Å²	77.1	41%	0.405	39%	0.394	S	S	.	.	H	α-helix	trans	-63.4	-31.9	175.9	0	0	0	0	0	112.6	A204 I205 E212 Y283	A204-A208 WeakPolarHBondContact O-CB 3.41Å; A204-A208 PolarHBondContact O-N 3.49Å; A204-A208 VanDerWaalsContact O-N 3.11Å; I205-A208 PolarHBondContact O-N 3.32Å; A208-E212 PolarHBondContact O-N 2.8Å; A208-Y283 HydrophobicContact CB-CE1 4.2Å; A208-Y283 PolarHBondContact O-OH 3.35Å
209	M	97.8	Very high	97.5	Very high	68 Å²	68	77.9 Å²	77.9	34%	0.335	40%	0.398	S	S	.	.	H	α-helix	trans	-75.5	-40.7	175.4	-173.4	-82.4	-71.5	0	0	111.9	I205 L206 D207 E211 E212 T213 Y283	I205-M209 PolarHBondContact O-N 2.98Å; L206-M209 PolarHBondContact O-N 3.08Å; D207-M209 VanDerWaalsContact C-N 3.26Å; D207-M209 PolarHBondContact O-N 2.91Å; M209-E211 VanDerWaalsContact C-N 3.33Å; M209-E211 PolarHBondContact O-N 3.31Å; M209-E212 PolarHBondContact O-N 3.34Å; M209-T213 WeakPolarHBondContact O-CB 3.34Å; M209-T213 PolarHBondContact O-N 2.72Å; M209-T213 PolarHBondContact O-OG1 2.73Å; M209-T213 PolarHBondContact SD-OG1 2.92Å; M209-T213 VanDerWaalsContact SD-OG1 3.36Å; M209-Y283 WeakPolarHBondContact CA-OH 3.36Å; M209-Y283 HydrophobicContact CB-CD1 4Å; M209-Y283 HydrophobicContact CB-CE1 3.68Å; M209-Y283 HydrophobicContact CB-CE2 4.27Å; M209-Y283 HydrophobicContact CB-CG 4.42Å; M209-Y283 HydrophobicContact CG-CD2 4.22Å; M209-Y283 HydrophobicContact CG-CE1 4.38Å; M209-Y283 HydrophobicContact CG-CE2 4.13Å; M209-Y283 HydrophobicContact CG-CG 4.43Å
210	A	98.1	Very high	97.4	Very high	54 Å²	54	72.1 Å²	72.1	45%	0.446	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-41.7	175.8	0	0	0	0	0	111.5	L206 D207 T213 R214	L206-A210 WeakPolarHBondContact O-CB 3.41Å; L206-A210 PolarHBondContact O-N 3.34Å; D207-A210 PolarHBondContact O-N 3.12Å; A210-T213 PolarHBondContact O-N 2.91Å; A210-R214 WeakPolarHBondContact O-CB 3.13Å; A210-R214 PolarHBondContact O-N 3.39Å
211	E	97.8	Very high	97.4	Very high	71 Å²	71	71.8 Å²	71.8	33%	0.332	38%	0.379	S	S	.	.	H	α-helix	trans	-66	-43	176.2	178.5	55.7	-163.4	0	0	112.1	D207 M209 T213 R214 Q215	D207-E211 PolarHBondContact O-N 3.22Å; M209-E211 VanDerWaalsContact C-N 3.33Å; M209-E211 PolarHBondContact O-N 3.31Å; E211-T213 VanDerWaalsContact C-N 3.35Å; E211-T213 PolarHBondContact O-N 2.83Å; E211-R214 VanDerWaalsContact CD-NH2 3.32Å; E211-R214 PolarHBondContact O-N 3.35Å; E211-R214 IonicContact OE1-CZ 3.98Å; E211-R214 IonicContact OE1-NE 2.68Å; E211-R214 IonicContact OE1-NH2 3.12Å; E211-R214 PolarHBondContact OE1-NH2 3.46Å; E211-R214 IonicContact OE2-CZ 3.71Å; E211-R214 IonicContact OE2-NE 3.41Å; E211-R214 PolarHBondContact OE2-NE 2.97Å; E211-R214 IonicContact OE2-NH2 3.45Å; E211-R214 PolarHBondContact OE2-NH2 3.25Å; E211-R214 VanDerWaalsContact OE2-NH2 3.14Å; E211-Q215 VanDerWaalsContact O-CG 3.29Å; E211-Q215 WeakPolarHBondContact O-CG 3.43Å; E211-Q215 PolarHBondContact O-N 3.43Å; E211-Q215 PolarHBondContact OE1-NE2 2.87Å
212	E	97.8	Very high	97.3	Very high	17 Å²	17	75 Å²	75	8%	0.079	39%	0.394	C	S	.	.	H	α-helix	trans	-60.1	-46.6	173.6	-178.9	171.8	152.8	0	0	111	A208 M209 R214 Q215 K216 I278 D279 K282 Y283	A208-E212 PolarHBondContact O-N 2.8Å; M209-E212 PolarHBondContact O-N 3.34Å; E212-R214 VanDerWaalsContact C-N 3.31Å; E212-R214 PolarHBondContact O-N 3.03Å; E212-Q215 PolarHBondContact O-N 3.06Å; E212-Q215 VanDerWaalsContact O-N 3.16Å; E212-K216 HydrophobicContact CG-CG 4.21Å; E212-K216 WeakPolarHBondContact O-CG 3.13Å; E212-K216 PolarHBondContact O-N 2.91Å; E212-I278 WeakPolarHBondContact OE1-CA 3.45Å; E212-D279 PolarHBondContact OE1-N 3.38Å; E212-K282 IonicContact OE2-NZ 3.66Å; E212-K282 PolarHBondContact OE2-NZ 2.94Å; E212-Y283 WeakPolarHBondContact CB-OH 3.42Å; E212-Y283 WeakPolarHBondContact OE2-CE2 3.22Å; E212-Y283 PolarHBondContact OE2-OH 2.73Å
213	T	97.8	Very high	97.2	Very high	51 Å²	51	73.2 Å²	73.2	31%	0.313	38%	0.384	S	S	.	.	H	α-helix	trans	-56.2	-47.1	177.7	-59.4	0	0	0	0	111.2	M209 A210 E211 Q215 K216 Q217 I278	M209-T213 WeakPolarHBondContact O-CB 3.34Å; M209-T213 PolarHBondContact O-N 2.72Å; M209-T213 PolarHBondContact O-OG1 2.73Å; M209-T213 PolarHBondContact SD-OG1 2.92Å; M209-T213 VanDerWaalsContact SD-OG1 3.36Å; A210-T213 PolarHBondContact O-N 2.91Å; E211-T213 VanDerWaalsContact C-N 3.35Å; E211-T213 PolarHBondContact O-N 2.83Å; T213-Q215 PolarHBondContact O-N 2.83Å; T213-K216 PolarHBondContact O-N 3.49Å; T213-Q217 WeakPolarHBondContact O-CB 3.4Å; T213-Q217 PolarHBondContact O-N 3.4Å; T213-I278 HydrophobicContact CG2-CD1 4.24Å; T213-I278 WeakPolarHBondContact OG1-CD1 3.12Å
214	R	98	Very high	97	Very high	128 Å²	128	74.1 Å²	74.1	48%	0.483	39%	0.39	S	S	.	.	H	α-helix	trans	-60.8	-45	177.5	-170.6	-172	70.5	79.2	1.9	111.6	A210 E211 E212 Q217 L218	A210-R214 WeakPolarHBondContact O-CB 3.13Å; A210-R214 PolarHBondContact O-N 3.39Å; E211-R214 VanDerWaalsContact CD-NH2 3.32Å; E211-R214 PolarHBondContact O-N 3.35Å; E211-R214 IonicContact OE1-CZ 3.98Å; E211-R214 IonicContact OE1-NE 2.68Å; E211-R214 IonicContact OE1-NH2 3.12Å; E211-R214 PolarHBondContact OE1-NH2 3.46Å; E211-R214 IonicContact OE2-CZ 3.71Å; E211-R214 IonicContact OE2-NE 3.41Å; E211-R214 PolarHBondContact OE2-NE 2.97Å; E211-R214 IonicContact OE2-NH2 3.45Å; E211-R214 PolarHBondContact OE2-NH2 3.25Å; E211-R214 VanDerWaalsContact OE2-NH2 3.14Å; E212-R214 VanDerWaalsContact C-N 3.31Å; E212-R214 PolarHBondContact O-N 3.03Å; R214-Q217 PolarHBondContact O-N 2.96Å; R214-L218 HydrophobicContact CG-CD1 4.44Å; R214-L218 VanDerWaalsContact NH1-CD1 3.32Å; R214-L218 WeakPolarHBondContact O-CG 3.43Å; R214-L218 PolarHBondContact O-N 3.03Å
215	Q	96.8	Very high	97	Very high	93 Å²	93	77.3 Å²	77.3	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-63.4	-45.3	178	-71.7	176.5	3.9	0	0	112.1	E211 E212 T213 L218 L219	E211-Q215 VanDerWaalsContact O-CG 3.29Å; E211-Q215 WeakPolarHBondContact O-CG 3.43Å; E211-Q215 PolarHBondContact O-N 3.43Å; E211-Q215 PolarHBondContact OE1-NE2 2.87Å; E212-Q215 PolarHBondContact O-N 3.06Å; E212-Q215 VanDerWaalsContact O-N 3.16Å; T213-Q215 PolarHBondContact O-N 2.83Å; Q215-L218 PolarHBondContact O-N 3.12Å; Q215-L219 WeakPolarHBondContact O-CG 3.42Å; Q215-L219 PolarHBondContact O-N 3.33Å; Q215-L219 VanDerWaalsContact O-N 3.14Å
216	K	96.1	Very high	96.9	Very high	54 Å²	54	78.6 Å²	78.6	24%	0.235	40%	0.399	C	S	.	.	H	α-helix	trans	-64.2	-40.6	177.6	-62.7	-51.6	179.7	-171.2	0	111.9	E212 T213 L219 A220 G275	E212-K216 HydrophobicContact CG-CG 4.21Å; E212-K216 WeakPolarHBondContact O-CG 3.13Å; E212-K216 PolarHBondContact O-N 2.91Å; T213-K216 PolarHBondContact O-N 3.49Å; K216-L219 PolarHBondContact O-N 3.2Å; K216-A220 WeakPolarHBondContact O-CB 3.49Å; K216-A220 PolarHBondContact O-N 3.06Å; K216-G275 WeakPolarHBondContact CE-O 3.35Å; K216-G275 PolarHBondContact NZ-O 3.39Å
217	Q	97.1	Very high	96.7	Very high	105 Å²	105	78.2 Å²	78.2	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-47.6	177.3	-172	62.3	50.6	0	0	111.5	T213 R214 L219 A220 D221	T213-Q217 WeakPolarHBondContact O-CB 3.4Å; T213-Q217 PolarHBondContact O-N 3.4Å; R214-Q217 PolarHBondContact O-N 2.96Å; Q217-L219 VanDerWaalsContact C-N 3.31Å; Q217-L219 PolarHBondContact O-N 3.36Å; Q217-A220 PolarHBondContact O-N 2.89Å; Q217-A220 VanDerWaalsContact O-N 3.14Å; Q217-D221 PolarHBondContact NE2-OD1 3.24Å; Q217-D221 VanDerWaalsContact O-CG 3.23Å; Q217-D221 PolarHBondContact O-N 2.88Å
218	L	97.1	Very high	96.6	Very high	94 Å²	94	77.6 Å²	77.6	49%	0.492	40%	0.397	S	S	.	.	H	α-helix	trans	-59.4	-41.1	178	-73.7	171.9	0	0	0	112.6	R214 Q215 D221 E222	R214-L218 HydrophobicContact CG-CD1 4.44Å; R214-L218 VanDerWaalsContact NH1-CD1 3.32Å; R214-L218 WeakPolarHBondContact O-CG 3.43Å; R214-L218 PolarHBondContact O-N 3.03Å; Q215-L218 PolarHBondContact O-N 3.12Å; L218-D221 PolarHBondContact O-N 2.51Å; L218-E222 WeakPolarHBondContact O-CB 3.39Å; L218-E222 PolarHBondContact O-N 2.69Å
219	L	95.8	Very high	96.4	Very high	97 Å²	97	80 Å²	80	51%	0.508	40%	0.4	S	S	.	.	H	α-helix	trans	-66	-39.4	176.6	-71.2	169.8	0	0	0	112	Q215 K216 Q217 K223 M276	Q215-L219 WeakPolarHBondContact O-CG 3.42Å; Q215-L219 PolarHBondContact O-N 3.33Å; Q215-L219 VanDerWaalsContact O-N 3.14Å; K216-L219 PolarHBondContact O-N 3.2Å; Q217-L219 VanDerWaalsContact C-N 3.31Å; Q217-L219 PolarHBondContact O-N 3.36Å; L219-K223 WeakPolarHBondContact O-CB 3.15Å; L219-K223 WeakPolarHBondContact O-CG 3.33Å; L219-K223 PolarHBondContact O-N 3.39Å; L219-K223 VanDerWaalsContact O-N 3.11Å; L219-M276 HydrophobicContact CB-CE 4.27Å
220	A	96	Very high	96.2	Very high	32 Å²	32	80.5 Å²	80.5	26%	0.264	40%	0.401	S	S	.	.	H	α-helix	trans	-65.6	-45.5	176	0	0	0	0	0	111.4	K216 Q217 E222 K223 M224	K216-A220 WeakPolarHBondContact O-CB 3.49Å; K216-A220 PolarHBondContact O-N 3.06Å; Q217-A220 PolarHBondContact O-N 2.89Å; Q217-A220 VanDerWaalsContact O-N 3.14Å; A220-E222 PolarHBondContact O-N 3.43Å; A220-K223 PolarHBondContact O-N 3.09Å; A220-M224 WeakPolarHBondContact O-CB 3.38Å; A220-M224 VanDerWaalsContact O-CG 3.3Å; A220-M224 WeakPolarHBondContact O-CG 3.15Å; A220-M224 PolarHBondContact O-N 3.15Å
221	D	97	Very high	96	Very high	75 Å²	75	82.2 Å²	82.2	40%	0.401	41%	0.406	S	S	.	.	H	α-helix	trans	-61.7	-44.3	179.4	-67.2	-17.9	0	0	0	111.5	Q217 L218 M224 K225	Q217-D221 PolarHBondContact NE2-OD1 3.24Å; Q217-D221 VanDerWaalsContact O-CG 3.23Å; Q217-D221 PolarHBondContact O-N 2.88Å; L218-D221 PolarHBondContact O-N 2.51Å; D221-M224 PolarHBondContact O-N 2.78Å; D221-K225 WeakPolarHBondContact O-CB 3.38Å; D221-K225 PolarHBondContact O-N 3.13Å
222	E	95.6	Very high	95.9	Very high	97 Å²	97	84 Å²	84	45%	0.453	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-42.8	177.1	-176.3	60.9	-156	0	0	111.4	L218 A220 K225 Q226	L218-E222 WeakPolarHBondContact O-CB 3.39Å; L218-E222 PolarHBondContact O-N 2.69Å; A220-E222 PolarHBondContact O-N 3.43Å; E222-K225 PolarHBondContact O-N 2.83Å; E222-Q226 VanDerWaalsContact O-CG 3.32Å; E222-Q226 WeakPolarHBondContact O-CG 3.39Å; E222-Q226 PolarHBondContact O-N 3.46Å; E222-Q226 PolarHBondContact OE1-NE2 2.98Å; E222-Q226 VanDerWaalsContact OE1-NE2 3.09Å
223	K	94.6	Very high	95.7	Very high	90 Å²	90	88.1 Å²	88.1	39%	0.391	44%	0.441	S	S	.	.	H	α-helix	trans	-66.7	-39.3	176	-75.8	-68.3	-178.9	-176.9	0	112.4	L219 A220 K225 Q226 L227 E270	L219-K223 WeakPolarHBondContact O-CB 3.15Å; L219-K223 WeakPolarHBondContact O-CG 3.33Å; L219-K223 PolarHBondContact O-N 3.39Å; L219-K223 VanDerWaalsContact O-N 3.11Å; A220-K223 PolarHBondContact O-N 3.09Å; K223-K225 VanDerWaalsContact C-N 3.33Å; K223-Q226 PolarHBondContact O-N 2.93Å; K223-L227 WeakPolarHBondContact O-CB 3.3Å; K223-L227 VanDerWaalsContact O-CG 3.3Å; K223-L227 WeakPolarHBondContact O-CG 3.29Å; K223-L227 PolarHBondContact O-N 2.86Å; K223-E270 IonicContact NZ-OE2 2.67Å
224	M	95.3	Very high	95.5	Very high	121 Å²	121	88.9 Å²	88.9	60%	0.596	44%	0.443	S	S	*	.	H	α-helix	trans	-62.4	-41.5	174.6	-76	177.5	60.2	0	0	111.5	A220 D221 T228	A220-M224 WeakPolarHBondContact O-CB 3.38Å; A220-M224 VanDerWaalsContact O-CG 3.3Å; A220-M224 WeakPolarHBondContact O-CG 3.15Å; A220-M224 PolarHBondContact O-N 3.15Å; D221-M224 PolarHBondContact O-N 2.78Å; M224-T228 WeakPolarHBondContact O-CB 3.47Å; M224-T228 PolarHBondContact O-N 3.33Å; M224-T228 PolarHBondContact O-OG1 2.92Å
225	K	96.6	Very high	95.4	Very high	117 Å²	117	84.9 Å²	84.9	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-48.3	176.8	-173.3	-176.5	172.7	-163.5	0	111.7	D221 E222 K223 L227 T228 E229	D221-K225 WeakPolarHBondContact O-CB 3.38Å; D221-K225 PolarHBondContact O-N 3.13Å; E222-K225 PolarHBondContact O-N 2.83Å; K223-K225 VanDerWaalsContact C-N 3.33Å; K225-L227 VanDerWaalsContact C-N 3.34Å; K225-L227 PolarHBondContact O-N 2.9Å; K225-T228 WeakPolarHBondContact O-CB 3.41Å; K225-T228 PolarHBondContact O-N 3.36Å; K225-T228 VanDerWaalsContact O-N 3.09Å; K225-E229 WeakPolarHBondContact CE-OE1 3.28Å; K225-E229 IonicContact NZ-OE1 3.27Å; K225-E229 PolarHBondContact O-N 2.85Å
226	Q	94.8	Very high	95.3	Very high	66 Å²	66	86.4 Å²	86.4	31%	0.308	44%	0.444	S	S	.	.	H	α-helix	trans	-56.1	-47.6	176.2	-73.2	171.6	5.9	0	0	111.7	E222 K223 T228 E229 E230	E222-Q226 VanDerWaalsContact O-CG 3.32Å; E222-Q226 WeakPolarHBondContact O-CG 3.39Å; E222-Q226 PolarHBondContact O-N 3.46Å; E222-Q226 PolarHBondContact OE1-NE2 2.98Å; E222-Q226 VanDerWaalsContact OE1-NE2 3.09Å; K223-Q226 PolarHBondContact O-N 2.93Å; Q226-T228 VanDerWaalsContact C-N 3.29Å; Q226-T228 PolarHBondContact O-N 3.02Å; Q226-E229 PolarHBondContact O-N 3.39Å; Q226-E230 WeakPolarHBondContact O-CG 3.27Å; Q226-E230 PolarHBondContact O-N 3.21Å
227	L	94.5	Very high	95.1	Very high	74 Å²	74	85 Å²	85	39%	0.387	44%	0.438	S	S	.	.	H	α-helix	trans	-64.2	-33.2	177.4	-71.7	171	0	0	0	112.7	K223 K225 T231 P269	K223-L227 WeakPolarHBondContact O-CB 3.3Å; K223-L227 VanDerWaalsContact O-CG 3.3Å; K223-L227 WeakPolarHBondContact O-CG 3.29Å; K223-L227 PolarHBondContact O-N 2.86Å; K225-L227 VanDerWaalsContact C-N 3.34Å; K225-L227 PolarHBondContact O-N 2.9Å; L227-T231 VanDerWaalsContact O-CB 3.27Å; L227-T231 WeakPolarHBondContact O-CB 3.4Å; L227-T231 PolarHBondContact O-N 2.89Å; L227-T231 PolarHBondContact O-OG1 3.13Å; L227-P269 HydrophobicContact CD2-CB 3.92Å
228	T	96.2	Very high	95	Very high	77 Å²	77	84.5 Å²	84.5	47%	0.472	44%	0.437	S	S	.	.	H	α-helix	trans	-66.3	-47.3	175.7	-56.3	0	0	0	0	110.6	M224 K225 Q226 E230 T231 E232	M224-T228 WeakPolarHBondContact O-CB 3.47Å; M224-T228 PolarHBondContact O-N 3.33Å; M224-T228 PolarHBondContact O-OG1 2.92Å; K225-T228 WeakPolarHBondContact O-CB 3.41Å; K225-T228 PolarHBondContact O-N 3.36Å; K225-T228 VanDerWaalsContact O-N 3.09Å; Q226-T228 VanDerWaalsContact C-N 3.29Å; Q226-T228 PolarHBondContact O-N 3.02Å; T228-E230 PolarHBondContact O-N 2.97Å; T228-T231 PolarHBondContact O-N 3.39Å; T228-E232 WeakPolarHBondContact O-CG 3.34Å; T228-E232 PolarHBondContact O-N 2.85Å
229	E	94.4	Very high	94.9	Very high	100 Å²	100	85.6 Å²	85.6	47%	0.467	44%	0.44	S	S	.	.	H	α-helix	trans	-61.4	-44	176.9	-68.5	173.7	-177.5	0	0	111.6	K225 Q226 T231 E232 V233	K225-E229 WeakPolarHBondContact CE-OE1 3.28Å; K225-E229 IonicContact NZ-OE1 3.27Å; K225-E229 PolarHBondContact O-N 2.85Å; Q226-E229 PolarHBondContact O-N 3.39Å; E229-T231 PolarHBondContact O-N 3Å; E229-E232 PolarHBondContact O-N 3.21Å; E229-V233 WeakPolarHBondContact O-CG2 3.18Å; E229-V233 PolarHBondContact O-N 3.44Å
230	E	92.7	Very high	94.8	Very high	77 Å²	77	85.8 Å²	85.8	36%	0.36	43%	0.434	S	S	.	.	H	α-helix	trans	-63.5	-40.5	175.5	-73.1	176.6	-176.8	0	0	112.2	Q226 T228 E232 V233 L234	Q226-E230 WeakPolarHBondContact O-CG 3.27Å; Q226-E230 PolarHBondContact O-N 3.21Å; T228-E230 PolarHBondContact O-N 2.97Å; E230-E232 VanDerWaalsContact C-N 3.34Å; E230-E232 PolarHBondContact O-N 3.23Å; E230-V233 PolarHBondContact O-N 3.45Å; E230-L234 WeakPolarHBondContact O-CG 3.31Å; E230-L234 PolarHBondContact O-N 3.32Å
231	T	94.3	Very high	94.7	Very high	90 Å²	90	86.2 Å²	86.2	55%	0.552	43%	0.432	S	S	*	.	H	α-helix	trans	-63.3	-40.8	176.2	-60.2	0	0	0	0	111.3	L227 T228 E229 L234 A235	L227-T231 VanDerWaalsContact O-CB 3.27Å; L227-T231 WeakPolarHBondContact O-CB 3.4Å; L227-T231 PolarHBondContact O-N 2.89Å; L227-T231 PolarHBondContact O-OG1 3.13Å; T228-T231 PolarHBondContact O-N 3.39Å; E229-T231 PolarHBondContact O-N 3Å; T231-L234 PolarHBondContact O-N 3.3Å; T231-A235 WeakPolarHBondContact O-CB 3.42Å; T231-A235 PolarHBondContact O-N 3.37Å
232	E	95.1	Very high	94.7	Very high	110 Å²	110	87.7 Å²	87.7	51%	0.514	44%	0.436	S	S	.	.	H	α-helix	trans	-63.1	-44	174.6	-73.7	178.1	-177.5	0	0	111.4	T228 E229 E230 L234 A235 H236	T228-E232 WeakPolarHBondContact O-CG 3.34Å; T228-E232 PolarHBondContact O-N 2.85Å; E229-E232 PolarHBondContact O-N 3.21Å; E230-E232 VanDerWaalsContact C-N 3.34Å; E230-E232 PolarHBondContact O-N 3.23Å; E232-L234 VanDerWaalsContact C-N 3.3Å; E232-L234 PolarHBondContact O-N 3.39Å; E232-A235 WeakPolarHBondContact O-CB 3.36Å; E232-A235 PolarHBondContact O-N 2.8Å; E232-H236 PolarHBondContact O-N 2.96Å; E232-H236 PolarHBondContact O-ND1 3.12Å
233	V	93.3	Very high	94.6	Very high	103 Å²	103	89 Å²	89	62%	0.624	44%	0.444	S	S	*	.	H	α-helix	trans	-58.6	-43.7	175.8	171.6	0	0	0	0	111.1	E229 E230 H236 E237	E229-V233 WeakPolarHBondContact O-CG2 3.18Å; E229-V233 PolarHBondContact O-N 3.44Å; E230-V233 PolarHBondContact O-N 3.45Å; V233-H236 PolarHBondContact O-N 3.11Å; V233-E237 PolarHBondContact O-N 3Å; V233-E237 VanDerWaalsContact O-N 3.09Å
234	L	94.2	Very high	94.5	Very high	67 Å²	67	85.3 Å²	85.3	35%	0.351	43%	0.428	S	S	.	.	H	α-helix	trans	-64.9	-39.8	176.1	-69.7	174.2	0	0	0	112.2	E230 T231 E232 H236 E237 I238 T266	E230-L234 WeakPolarHBondContact O-CG 3.31Å; E230-L234 PolarHBondContact O-N 3.32Å; T231-L234 PolarHBondContact O-N 3.3Å; E232-L234 VanDerWaalsContact C-N 3.3Å; E232-L234 PolarHBondContact O-N 3.39Å; L234-H236 PolarHBondContact O-N 3.01Å; L234-E237 WeakPolarHBondContact O-CB 3.41Å; L234-E237 PolarHBondContact O-N 2.86Å; L234-I238 VanDerWaalsContact O-CG1 3.31Å; L234-I238 WeakPolarHBondContact O-CG1 3.38Å; L234-I238 PolarHBondContact O-N 2.91Å; L234-T266 HydrophobicContact CD2-CG2 3.78Å
235	A	95.4	Very high	94.4	Very high	43 Å²	43	86.1 Å²	86.1	36%	0.355	43%	0.432	S	S	.	.	H	α-helix	trans	-60	-44.9	176.1	0	0	0	0	0	111.8	T231 E232 E237 I238 E239	T231-A235 WeakPolarHBondContact O-CB 3.42Å; T231-A235 PolarHBondContact O-N 3.37Å; E232-A235 WeakPolarHBondContact O-CB 3.36Å; E232-A235 PolarHBondContact O-N 2.8Å; A235-E237 VanDerWaalsContact C-N 3.33Å; A235-E237 PolarHBondContact O-N 3.46Å; A235-I238 WeakPolarHBondContact O-CB 3.24Å; A235-I238 PolarHBondContact O-N 2.86Å; A235-E239 PolarHBondContact O-N 3.41Å
236	H	94.4	Very high	94.3	Very high	126 Å²	126	88.4 Å²	88.4	58%	0.583	44%	0.442	S	S	*	.	H	α-helix	trans	-63.5	-35.8	175.1	-69.8	90.1	0	0	0	112.4	E232 V233 L234 R240	E232-H236 PolarHBondContact O-N 2.96Å; E232-H236 PolarHBondContact O-ND1 3.12Å; V233-H236 PolarHBondContact O-N 3.11Å; L234-H236 PolarHBondContact O-N 3.01Å; H236-R240 WeakPolarHBondContact O-CB 3.23Å; H236-R240 PolarHBondContact O-N 3.44Å
237	E	93.5	Very high	94.3	Very high	24 Å²	24	88.5 Å²	88.5	11%	0.112	44%	0.442	C	S	.	.	H	α-helix	trans	-64	-43.7	173.6	-169	65.6	-145.3	0	0	111.5	V233 L234 A235 R240 L241 R262 L263	V233-E237 PolarHBondContact O-N 3Å; V233-E237 VanDerWaalsContact O-N 3.09Å; L234-E237 WeakPolarHBondContact O-CB 3.41Å; L234-E237 PolarHBondContact O-N 2.86Å; A235-E237 VanDerWaalsContact C-N 3.33Å; A235-E237 PolarHBondContact O-N 3.46Å; E237-R240 PolarHBondContact O-N 2.83Å; E237-R240 IonicContact OE1-CZ 2.84Å; E237-R240 IonicContact OE1-NE 3.14Å; E237-R240 PolarHBondContact OE1-NE 3.3Å; E237-R240 IonicContact OE1-NH2 2.69Å; E237-R240 PolarHBondContact OE1-NH2 2.71Å; E237-R240 IonicContact OE2-CZ 3.41Å; E237-R240 IonicContact OE2-NE 3.55Å; E237-R240 IonicContact OE2-NH2 2.67Å; E237-R240 PolarHBondContact OE2-NH2 2.86Å; E237-L241 WeakPolarHBondContact O-CG 3.35Å; E237-L241 PolarHBondContact O-N 3.38Å; E237-R262 IonicContact OE1-CZ 3.92Å; E237-R262 IonicContact OE1-NE 3.39Å; E237-R262 PolarHBondContact OE1-NE 3.39Å; E237-R262 IonicContact OE1-NH2 3.51Å; E237-L263 HydrophobicContact CG-CD2 3.81Å
238	I	94.1	Very high	94.3	Very high	94 Å²	94	89.2 Å²	89.2	48%	0.482	45%	0.447	S	S	.	.	H	α-helix	trans	-60.8	-48.8	178.6	-68.7	164.5	0	0	0	110.1	L234 A235 R240 L241 Q242	L234-I238 VanDerWaalsContact O-CG1 3.31Å; L234-I238 WeakPolarHBondContact O-CG1 3.38Å; L234-I238 PolarHBondContact O-N 2.91Å; A235-I238 WeakPolarHBondContact O-CB 3.24Å; A235-I238 PolarHBondContact O-N 2.86Å; I238-R240 VanDerWaalsContact C-N 3.33Å; I238-R240 PolarHBondContact O-N 3.48Å; I238-L241 WeakPolarHBondContact O-CB 3.27Å; I238-L241 PolarHBondContact O-N 3.46Å; I238-Q242 VanDerWaalsContact O-CG 3.32Å; I238-Q242 WeakPolarHBondContact O-CG 3.49Å; I238-Q242 PolarHBondContact O-N 3.18Å
239	E	95.9	Very high	94.2	Very high	117 Å²	117	92 Å²	92	55%	0.547	46%	0.458	S	S	.	.	H	α-helix	trans	-59.7	-43.7	176.9	-72.9	-178.6	-177.9	0	0	111.7	A235 L241 Q242 M243	A235-E239 PolarHBondContact O-N 3.41Å; E239-L241 PolarHBondContact O-N 2.8Å; E239-Q242 WeakPolarHBondContact O-CB 3.37Å; E239-Q242 PolarHBondContact O-N 3.38Å; E239-M243 WeakPolarHBondContact O-CG 3.21Å; E239-M243 PolarHBondContact O-N 3.22Å
240	R	93.6	Very high	94.1	Very high	102 Å²	102	92.1 Å²	92.1	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-60.3	-44.8	175.7	179.6	168.5	65	-174.5	-0.4	111.8	H236 E237 I238 Q242 M243 E244 R262	H236-R240 WeakPolarHBondContact O-CB 3.23Å; H236-R240 PolarHBondContact O-N 3.44Å; E237-R240 PolarHBondContact O-N 2.83Å; E237-R240 IonicContact OE1-CZ 2.84Å; E237-R240 IonicContact OE1-NE 3.14Å; E237-R240 PolarHBondContact OE1-NE 3.3Å; E237-R240 IonicContact OE1-NH2 2.69Å; E237-R240 PolarHBondContact OE1-NH2 2.71Å; E237-R240 IonicContact OE2-CZ 3.41Å; E237-R240 IonicContact OE2-NE 3.55Å; E237-R240 IonicContact OE2-NH2 2.67Å; E237-R240 PolarHBondContact OE2-NH2 2.86Å; I238-R240 VanDerWaalsContact C-N 3.33Å; I238-R240 PolarHBondContact O-N 3.48Å; R240-Q242 VanDerWaalsContact C-N 3.32Å; R240-Q242 PolarHBondContact O-N 3.24Å; R240-M243 PolarHBondContact O-N 2.93Å; R240-E244 HydrophobicContact CG-CG 4.37Å; R240-E244 WeakPolarHBondContact O-CG 3.34Å; R240-E244 PolarHBondContact O-N 3.36Å; R240-R262 VanDerWaalsContact CZ-NE 3.34Å
241	L	94.3	Very high	94.2	Very high	41 Å²	41	90.6 Å²	90.6	22%	0.215	46%	0.464	C	S	.	.	H	α-helix	trans	-59.7	-43.7	175.4	-74.2	178.7	0	0	0	111.6	E237 I238 E239 M243 E244 M245 R259 L263	E237-L241 WeakPolarHBondContact O-CG 3.35Å; E237-L241 PolarHBondContact O-N 3.38Å; I238-L241 WeakPolarHBondContact O-CB 3.27Å; I238-L241 PolarHBondContact O-N 3.46Å; E239-L241 PolarHBondContact O-N 2.8Å; L241-M243 VanDerWaalsContact C-N 3.3Å; L241-M243 PolarHBondContact O-N 3.39Å; L241-E244 PolarHBondContact O-N 3.2Å; L241-M245 WeakPolarHBondContact O-CB 3.43Å; L241-M245 VanDerWaalsContact O-CG 3.25Å; L241-M245 WeakPolarHBondContact O-CG 3.42Å; L241-M245 PolarHBondContact O-N 3.19Å; L241-R259 VanDerWaalsContact CD2-CD 3.5Å; L241-R259 HydrophobicContact CD2-CG 3.62Å; L241-L263 HydrophobicContact CD1-CD1 4.3Å; L241-L263 HydrophobicContact CD1-CD2 3.73Å; L241-L263 HydrophobicContact CD2-CD1 4.16Å; L241-L263 HydrophobicContact CD2-CD2 4.38Å; L241-L263 HydrophobicContact CG-CD2 4.36Å
242	Q	95.2	Very high	94.2	Very high	105 Å²	105	89.4 Å²	89.4	49%	0.491	45%	0.451	S	S	.	.	H	α-helix	trans	-62.1	-36.9	177.6	-71.1	174	-2.2	0	0	112.5	I238 E239 R240	I238-Q242 VanDerWaalsContact O-CG 3.32Å; I238-Q242 WeakPolarHBondContact O-CG 3.49Å; I238-Q242 PolarHBondContact O-N 3.18Å; E239-Q242 WeakPolarHBondContact O-CB 3.37Å; E239-Q242 PolarHBondContact O-N 3.38Å; R240-Q242 VanDerWaalsContact C-N 3.32Å; R240-Q242 PolarHBondContact O-N 3.24Å
243	M	94.1	Very high	94.1	Very high	126 Å²	126	89.7 Å²	89.7	62%	0.621	46%	0.455	S	S	*	.	H	α-helix	trans	-71.7	-45.3	175.7	-67.7	-66	-87.5	0	0	111.5	E239 R240 L241 M245 K246	E239-M243 WeakPolarHBondContact O-CG 3.21Å; E239-M243 PolarHBondContact O-N 3.22Å; R240-M243 PolarHBondContact O-N 2.93Å; L241-M243 VanDerWaalsContact C-N 3.3Å; L241-M243 PolarHBondContact O-N 3.39Å; M243-M245 PolarHBondContact O-N 3.12Å; M243-K246 PolarHBondContact O-N 2.82Å
244	E	93.4	Very high	94	Very high	12 Å²	12	92.3 Å²	92.3	6%	0.056	46%	0.463	C	S	.	.	H	α-helix	trans	-59.8	-36.1	176.2	-72.2	-177.6	-162.5	0	0	111.4	R240 L241 K246 E247 F252 K255 R259 R262	R240-E244 HydrophobicContact CG-CG 4.37Å; R240-E244 WeakPolarHBondContact O-CG 3.34Å; R240-E244 PolarHBondContact O-N 3.36Å; L241-E244 PolarHBondContact O-N 3.2Å; E244-K246 PolarHBondContact O-N 2.96Å; E244-K246 VanDerWaalsContact O-N 3.16Å; E244-E247 WeakPolarHBondContact O-CB 3.27Å; E244-E247 PolarHBondContact O-N 3.4Å; E244-E247 VanDerWaalsContact O-N 3.15Å; E244-F252 WeakPolarHBondContact O-CD2 3.32Å; E244-K255 HydrophobicContact CG-CD 4.48Å; E244-R259 IonicContact OE2-CZ 3.09Å; E244-R259 IonicContact OE2-NE 2.69Å; E244-R259 PolarHBondContact OE2-NE 2.83Å; E244-R259 IonicContact OE2-NH2 2.75Å; E244-R259 PolarHBondContact OE2-NH2 2.99Å; E244-R262 IonicContact OE1-CZ 3.71Å; E244-R262 IonicContact OE1-NH1 2.86Å; E244-R262 IonicContact OE1-NH2 2.82Å; E244-R262 PolarHBondContact OE1-NH2 3.21Å; E244-R262 IonicContact OE2-NH2 3.74Å
245	M	92.9	Very high	94	Very high	138 Å²	138	92.6 Å²	92.6	68%	0.68	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.3	175.9	-76.7	177.1	68.1	0	0	114.9	L241 M243 F252	L241-M245 WeakPolarHBondContact O-CB 3.43Å; L241-M245 VanDerWaalsContact O-CG 3.25Å; L241-M245 WeakPolarHBondContact O-CG 3.42Å; L241-M245 PolarHBondContact O-N 3.19Å; M243-M245 PolarHBondContact O-N 3.12Å; M245-F252 HydrophobicContact CG-CE2 4.26Å
246	K	94	Very high	93.8	Very high	165 Å²	165	95.4 Å²	95.4	72%	0.717	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-3	177.9	-63.4	172.9	-175.1	172.2	0	113.1	M243 E244	M243-K246 PolarHBondContact O-N 2.82Å; E244-K246 PolarHBondContact O-N 2.96Å; E244-K246 VanDerWaalsContact O-N 3.16Å
247	E	93.9	Very high	93.6	Very high	67 Å²	67	97.4 Å²	97.4	31%	0.313	47%	0.474	S	S	.	.	S	Bend	trans	-74.5	166.6	178.3	-63.8	-177.9	172.7	0	0	112	E244 K255	E244-E247 WeakPolarHBondContact O-CB 3.27Å; E244-E247 PolarHBondContact O-N 3.4Å; E244-E247 VanDerWaalsContact O-N 3.15Å; E247-K255 IonicContact OE1-NZ 2.68Å; E247-K255 PolarHBondContact OE1-NZ 3.37Å; E247-K255 IonicContact OE2-NZ 2.75Å; E247-K255 PolarHBondContact OE2-NZ 3.49Å
248	D	94.8	Very high	93.5	Very high	90 Å²	90	98.9 Å²	98.9	48%	0.481	49%	0.487	S	S	.	.			trans	-66.6	157.4	172.8	72.8	91.6	0	0	0	112.2	V250 S251 F252	D248-V250 VanDerWaalsContact C-N 3.25Å; D248-V250 PolarHBondContact O-N 3.38Å; D248-V250 VanDerWaalsContact O-N 3.14Å; D248-V250 WeakPolarHBondContact OD1-CB 3.42Å; D248-V250 PolarHBondContact OD1-N 3.12Å; D248-V250 VanDerWaalsContact OD1-N 3.07Å; D248-S251 PolarHBondContact O-N 2.9Å; D248-S251 PolarHBondContact OD1-N 2.69Å; D248-S251 PolarHBondContact OD1-OG 2.94Å; D248-S251 WeakPolarHBondContact OD2-CB 3.09Å; D248-S251 PolarHBondContact OD2-OG 3.27Å; D248-F252 WeakPolarHBondContact O-CB 3.4Å; D248-F252 PolarHBondContact O-N 3.43Å
249	D	94.1	Very high	93.5	Very high	135 Å²	135	95.5 Å²	95.5	72%	0.722	47%	0.468	S	S	*	.	H	α-helix	trans	-55	-36.9	-173.4	-65.6	-21.7	0	0	0	113.5	L253	D249-L253 WeakPolarHBondContact O-CB 3.31Å; D249-L253 WeakPolarHBondContact O-CD1 3.35Å; D249-L253 WeakPolarHBondContact O-CG 3.5Å; D249-L253 PolarHBondContact O-N 3.15Å; D249-L253 VanDerWaalsContact O-N 3.15Å
250	V	93.8	Very high	93.3	Very high	102 Å²	102	97 Å²	97	62%	0.618	47%	0.472	S	S	*	.	H	α-helix	trans	-74.4	-48.4	-177.3	-178.7	0	0	0	0	110.2	D248 F252 L253 M254	D248-V250 VanDerWaalsContact C-N 3.25Å; D248-V250 PolarHBondContact O-N 3.38Å; D248-V250 VanDerWaalsContact O-N 3.14Å; D248-V250 WeakPolarHBondContact OD1-CB 3.42Å; D248-V250 PolarHBondContact OD1-N 3.12Å; D248-V250 VanDerWaalsContact OD1-N 3.07Å; V250-F252 VanDerWaalsContact C-N 3.34Å; V250-F252 PolarHBondContact O-N 3.23Å; V250-L253 PolarHBondContact O-N 2.91Å; V250-M254 HydrophobicContact CG1-CG 4.46Å; V250-M254 VanDerWaalsContact O-CG 3.28Å; V250-M254 WeakPolarHBondContact O-CG 3.48Å; V250-M254 PolarHBondContact O-N 2.6Å
251	S	92.9	Very high	93.1	Very high	46 Å²	46	101 Å²	101	32%	0.322	49%	0.488	S	S	.	.	H	α-helix	trans	-60.5	-42.6	176.9	-63	0	0	0	0	112.1	D248 L253 M254	D248-S251 PolarHBondContact O-N 2.9Å; D248-S251 PolarHBondContact OD1-N 2.69Å; D248-S251 PolarHBondContact OD1-OG 2.94Å; D248-S251 WeakPolarHBondContact OD2-CB 3.09Å; D248-S251 PolarHBondContact OD2-OG 3.27Å; S251-L253 PolarHBondContact O-N 3.31Å; S251-M254 PolarHBondContact O-N 3.38Å
252	F	94.3	Very high	93	Very high	65 Å²	65	102.1 Å²	102.1	29%	0.285	49%	0.489	S	S	.	.	H	α-helix	trans	-59.5	-46.2	176.8	177.9	-96.6	0	0	0	112.1	E244 M245 D248 V250	E244-F252 WeakPolarHBondContact O-CD2 3.32Å; M245-F252 HydrophobicContact CG-CE2 4.26Å; D248-F252 WeakPolarHBondContact O-CB 3.4Å; D248-F252 PolarHBondContact O-N 3.43Å; V250-F252 VanDerWaalsContact C-N 3.34Å; V250-F252 PolarHBondContact O-N 3.23Å
253	L	93.7	Very high	92.7	Very high	115 Å²	115	100.3 Å²	100.3	60%	0.602	48%	0.482	S	S	*	.	H	α-helix	trans	-72.6	-35.6	-178.6	-71.6	173.8	0	0	0	112.9	D249 V250 S251 K255 H256	D249-L253 WeakPolarHBondContact O-CB 3.31Å; D249-L253 WeakPolarHBondContact O-CD1 3.35Å; D249-L253 WeakPolarHBondContact O-CG 3.5Å; D249-L253 PolarHBondContact O-N 3.15Å; D249-L253 VanDerWaalsContact O-N 3.15Å; V250-L253 PolarHBondContact O-N 2.91Å; S251-L253 PolarHBondContact O-N 3.31Å; L253-K255 PolarHBondContact O-N 3.19Å; L253-H256 VanDerWaalsContact O-CB 3.23Å; L253-H256 WeakPolarHBondContact O-CB 3.35Å; L253-H256 PolarHBondContact O-N 2.76Å; L253-H256 VanDerWaalsContact O-N 3.08Å
254	M	92.3	Very high	92.4	Very high	159 Å²	159	103 Å²	103	78%	0.783	49%	0.491	S	S	*	.	H	α-helix	trans	-59.4	-31.8	177.8	-77.1	-70.8	-79.8	0	0	112.6	V250 S251	V250-M254 HydrophobicContact CG1-CG 4.46Å; V250-M254 VanDerWaalsContact O-CG 3.28Å; V250-M254 WeakPolarHBondContact O-CG 3.48Å; V250-M254 PolarHBondContact O-N 2.6Å; S251-M254 PolarHBondContact O-N 3.38Å
255	K	93.3	Very high	91.9	Very high	72 Å²	72	107.1 Å²	107.1	31%	0.313	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.5	179.1	-64.7	171.9	-174.6	167.4	0	114.1	E244 E247 L253 K257 S258 R259	E244-K255 HydrophobicContact CG-CD 4.48Å; E247-K255 IonicContact OE1-NZ 2.68Å; E247-K255 PolarHBondContact OE1-NZ 3.37Å; E247-K255 IonicContact OE2-NZ 2.75Å; E247-K255 PolarHBondContact OE2-NZ 3.49Å; L253-K255 PolarHBondContact O-N 3.19Å; K255-K257 PolarHBondContact O-N 3.4Å; K255-S258 PolarHBondContact O-N 3.44Å; K255-S258 PolarHBondContact O-OG 3.38Å; K255-R259 WeakPolarHBondContact O-CB 3.34Å; K255-R259 PolarHBondContact O-N 2.91Å
256	H	91.1	Very high	91.6	Very high	102 Å²	102	103.3 Å²	103.3	47%	0.472	50%	0.504	S	S	.	.	H	α-helix	trans	-55.8	-45.8	-173.1	178.7	77.1	0	0	0	113.6	L253 S258 R259 K260	L253-H256 VanDerWaalsContact O-CB 3.23Å; L253-H256 WeakPolarHBondContact O-CB 3.35Å; L253-H256 PolarHBondContact O-N 2.76Å; L253-H256 VanDerWaalsContact O-N 3.08Å; H256-S258 PolarHBondContact O-N 3.05Å; H256-R259 PolarHBondContact O-N 3.49Å; H256-K260 WeakPolarHBondContact O-CB 3.49Å; H256-K260 PolarHBondContact O-N 3Å
257	K	90.4	Very high	91	Very high	169 Å²	169	101.9 Å²	101.9	74%	0.735	50%	0.502	S	S	*	.	H	α-helix	trans	-65.4	-38	-178.5	-74.6	-174.8	179.3	176.8	0	112.7	K255 R261	K255-K257 PolarHBondContact O-N 3.4Å; K257-R261 WeakPolarHBondContact O-CG 3.26Å; K257-R261 PolarHBondContact O-N 2.88Å
258	S	90.6	Very high	90.7	Very high	54 Å²	54	106.4 Å²	106.4	38%	0.378	52%	0.523	S	S	.	.	H	α-helix	trans	-75.7	-42.7	178.5	58.2	0	0	0	0	110.8	K255 H256 K260 R261 R262	K255-S258 PolarHBondContact O-N 3.44Å; K255-S258 PolarHBondContact O-OG 3.38Å; H256-S258 PolarHBondContact O-N 3.05Å; S258-K260 PolarHBondContact O-N 3.25Å; S258-R261 PolarHBondContact O-N 3.38Å; S258-R262 WeakPolarHBondContact O-CG 3.41Å; S258-R262 PolarHBondContact O-N 3.34Å
259	R	94.2	Very high	90.4	Very high	24 Å²	24	106 Å²	106	9%	0.091	53%	0.526	C	S	.	.	H	α-helix	trans	-54.3	-52.2	173.8	-174.6	-171.3	-58.6	160.7	9.4	112.2	L241 E244 K255 H256 R261 R262 L263	L241-R259 VanDerWaalsContact CD2-CD 3.5Å; L241-R259 HydrophobicContact CD2-CG 3.62Å; E244-R259 IonicContact OE2-CZ 3.09Å; E244-R259 IonicContact OE2-NE 2.69Å; E244-R259 PolarHBondContact OE2-NE 2.83Å; E244-R259 IonicContact OE2-NH2 2.75Å; E244-R259 PolarHBondContact OE2-NH2 2.99Å; K255-R259 WeakPolarHBondContact O-CB 3.34Å; K255-R259 PolarHBondContact O-N 2.91Å; H256-R259 PolarHBondContact O-N 3.49Å; R259-R261 VanDerWaalsContact C-N 3.26Å; R259-R261 PolarHBondContact O-N 3.23Å; R259-R262 PolarHBondContact O-N 3.15Å; R259-R262 VanDerWaalsContact O-N 3.13Å; R259-L263 HydrophobicContact CG-CD1 4.01Å; R259-L263 HydrophobicContact CG-CG 4.46Å; R259-L263 WeakPolarHBondContact O-CG 3.06Å; R259-L263 PolarHBondContact O-N 2.9Å
260	K	91.7	Very high	90.1	Very high	147 Å²	147	105.8 Å²	105.8	64%	0.639	52%	0.52	S	S	*	.	H	α-helix	trans	-57.9	-38.2	180	-173.4	176.4	-179.7	176.8	0	112.4	H256 S258 F264	H256-K260 WeakPolarHBondContact O-CB 3.49Å; H256-K260 PolarHBondContact O-N 3Å; S258-K260 PolarHBondContact O-N 3.25Å; K260-F264 WeakPolarHBondContact O-CB 3.09Å; K260-F264 PolarHBondContact O-N 2.94Å; K260-F264 VanDerWaalsContact O-N 3.13Å
261	R	90.3	Very high	89.9	Confident	188 Å²	188	105.9 Å²	105.9	71%	0.709	52%	0.522	S	S	*	.	H	α-helix	trans	-67.3	-43.8	176.2	-72.7	-179.6	-166.6	-134.9	2.5	112.1	K257 S258 R259 F264 C265	K257-R261 WeakPolarHBondContact O-CG 3.26Å; K257-R261 PolarHBondContact O-N 2.88Å; S258-R261 PolarHBondContact O-N 3.38Å; R259-R261 VanDerWaalsContact C-N 3.26Å; R259-R261 PolarHBondContact O-N 3.23Å; R261-F264 PolarHBondContact O-N 3.32Å; R261-C265 PolarHBondContact O-N 2.94Å; R261-C265 PolarHBondContact O-SG 2.86Å
262	R	92.2	Very high	89.9	Confident	64 Å²	64	109.9 Å²	109.9	24%	0.242	55%	0.545	C	S	.	.	H	α-helix	trans	-62.9	-45.1	-180	-64.5	179.8	-34.4	-126.8	9.8	111.9	E237 R240 E244 S258 R259 F264 C265 T266	E237-R262 IonicContact OE1-CZ 3.92Å; E237-R262 IonicContact OE1-NE 3.39Å; E237-R262 PolarHBondContact OE1-NE 3.39Å; E237-R262 IonicContact OE1-NH2 3.51Å; R240-R262 VanDerWaalsContact CZ-NE 3.34Å; E244-R262 IonicContact OE1-CZ 3.71Å; E244-R262 IonicContact OE1-NH1 2.86Å; E244-R262 IonicContact OE1-NH2 2.82Å; E244-R262 PolarHBondContact OE1-NH2 3.21Å; E244-R262 IonicContact OE2-NH2 3.74Å; S258-R262 WeakPolarHBondContact O-CG 3.41Å; S258-R262 PolarHBondContact O-N 3.34Å; R259-R262 PolarHBondContact O-N 3.15Å; R259-R262 VanDerWaalsContact O-N 3.13Å; R262-F264 VanDerWaalsContact C-N 3.28Å; R262-F264 PolarHBondContact O-N 3.38Å; R262-C265 PolarHBondContact O-N 3.23Å; R262-T266 PolarHBondContact O-N 3.07Å
263	L	89.3	Confident	89.7	Confident	67 Å²	67	111.7 Å²	111.7	35%	0.351	55%	0.554	S	S	.	*	H	α-helix	trans	-67	-28.8	177	-63	174.9	0	0	0	113.1	E237 L241 R259 C265 T266	E237-L263 HydrophobicContact CG-CD2 3.81Å; L241-L263 HydrophobicContact CD1-CD1 4.3Å; L241-L263 HydrophobicContact CD1-CD2 3.73Å; L241-L263 HydrophobicContact CD2-CD1 4.16Å; L241-L263 HydrophobicContact CD2-CD2 4.38Å; L241-L263 HydrophobicContact CG-CD2 4.36Å; R259-L263 HydrophobicContact CG-CD1 4.01Å; R259-L263 HydrophobicContact CG-CG 4.46Å; R259-L263 WeakPolarHBondContact O-CG 3.06Å; R259-L263 PolarHBondContact O-N 2.9Å; L263-C265 VanDerWaalsContact C-N 3.26Å; L263-T266 PolarHBondContact O-OG1 3.21Å
264	F	87.9	Confident	89.5	Confident	183 Å²	183	112 Å²	112	80%	0.803	56%	0.563	S	S	*	*	H	α-helix	trans	-72.5	-23.5	173.1	-173.3	-95.5	0	0	0	112.5	K260 R261 R262	K260-F264 WeakPolarHBondContact O-CB 3.09Å; K260-F264 PolarHBondContact O-N 2.94Å; K260-F264 VanDerWaalsContact O-N 3.13Å; R261-F264 PolarHBondContact O-N 3.32Å; R262-F264 VanDerWaalsContact C-N 3.28Å; R262-F264 PolarHBondContact O-N 3.38Å
265	C	82.9	Confident	89.4	Confident	97 Å²	97	106.9 Å²	106.9	66%	0.655	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	2.8	179.5	-64	0	0	0	0	113.8	R261 R262 L263	R261-C265 PolarHBondContact O-N 2.94Å; R261-C265 PolarHBondContact O-SG 2.86Å; R262-C265 PolarHBondContact O-N 3.23Å; L263-C265 VanDerWaalsContact C-N 3.26Å
266	T	85.9	Confident	89.4	Confident	59 Å²	59	106.1 Å²	106.1	36%	0.362	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-70.4	132.4	173.5	53.3	0	0	0	0	109.6	L234 R262 L263	L234-T266 HydrophobicContact CD2-CG2 3.78Å; R262-T266 PolarHBondContact O-N 3.07Å; L263-T266 PolarHBondContact O-OG1 3.21Å
267	M	81.9	Confident	89.6	Confident	135 Å²	135	108.2 Å²	108.2	67%	0.665	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-84	149.5	179.2	-65.4	-175.2	61.8	0	0	111
268	E	86.6	Confident	89.9	Confident	162 Å²	162	103.5 Å²	103.5	76%	0.757	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-94	144.7	168.5	-70.2	-70.9	163.8	0	0	108.9
269	P	88.5	Confident	90.1	Very high	82 Å²	82	104.7 Å²	104.7	53%	0.532	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-66.3	136.8	-179.4	26.8	-33.1	0	0	0	111.1	L227	L227-P269 HydrophobicContact CD2-CB 3.92Å
270	E	88	Confident	90.2	Very high	130 Å²	130	107.7 Å²	107.7	61%	0.607	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-67.4	142.7	174	-67.4	-176.2	162.1	0	0	111.2	K223	K223-E270 IonicContact NZ-OE2 2.67Å
271	P	90	Very high	90.4	Very high	103 Å²	103	105.5 Å²	105.5	67%	0.669	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-66	154.4	174.4	29	-34.3	0	0	0	111.1	Q273	P271-Q273 PolarHBondContact O-N 3.44Å; P271-Q273 PolarHBondContact O-NE2 2.89Å
272	V	92.3	Very high	90.6	Very high	131 Å²	131	101.1 Å²	101.1	79%	0.794	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-58.1	124.3	175.7	-179.1	0	0	0	0	109.6	M276	V272-M276 HydrophobicContact CG1-CB 4.44Å; V272-M276 HydrophobicContact CG1-CG 4.09Å
273	Q	89.8	Confident	90.8	Very high	102 Å²	102	99.2 Å²	99.2	48%	0.477	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-75.1	150	-177.5	-61.8	-61.7	-32.3	0	0	111.5	P271 M276	P271-Q273 PolarHBondContact O-N 3.44Å; P271-Q273 PolarHBondContact O-NE2 2.89Å; Q273-M276 WeakPolarHBondContact O-CG 3.28Å
274	P	90.6	Very high	91.1	Very high	122 Å²	122	101.5 Å²	101.5	79%	0.792	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	149.4	170.9	-23.1	33.8	0	0	0	112.2
275	G	90.1	Very high	91.5	Very high	52 Å²	52	94.4 Å²	94.4	54%	0.536	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	17	175.8	0	0	0	0	0	115.1	K216 L277	K216-G275 WeakPolarHBondContact CE-O 3.35Å; K216-G275 PolarHBondContact NZ-O 3.39Å; G275-L277 VanDerWaalsContact C-N 3.28Å
276	M	92.9	Very high	92.1	Very high	55 Å²	55	94 Å²	94	27%	0.271	54%	0.538	S	S	.	.			trans	-76.7	-15.9	173.3	-66.1	-65	-70.9	0	0	113.4	L219 V272 Q273	L219-M276 HydrophobicContact CB-CE 4.27Å; V272-M276 HydrophobicContact CG1-CB 4.44Å; V272-M276 HydrophobicContact CG1-CG 4.09Å; Q273-M276 WeakPolarHBondContact O-CG 3.28Å
277	L	95.4	Very high	92.5	Very high	147 Å²	147	93.6 Å²	93.6	77%	0.77	53%	0.533	S	S	*	.	S	Bend	trans	-95.1	160.5	179.5	-56.8	-179.8	0	0	0	111.4	G275	G275-L277 VanDerWaalsContact C-N 3.28Å
278	I	96.7	Very high	93.2	Very high	69 Å²	69	95.4 Å²	95.4	35%	0.354	54%	0.54	S	S	.	.			trans	-67.5	132.8	172.2	-60.1	169.1	0	0	0	109.4	E212 T213 V280 Y283	E212-I278 WeakPolarHBondContact OE1-CA 3.45Å; T213-I278 HydrophobicContact CG2-CD1 4.24Å; T213-I278 WeakPolarHBondContact OG1-CD1 3.12Å; I278-V280 PolarHBondContact O-N 3.11Å; I278-Y283 HydrophobicContact CG2-CD2 4.39Å; I278-Y283 HydrophobicContact CG2-CE2 4.16Å
279	D	95.5	Very high	93.5	Very high	79 Å²	79	91.4 Å²	91.4	42%	0.422	52%	0.519	S	S	.	.			trans	-79.1	86.7	176.2	-173.9	-11.7	0	0	0	111.4	E212 C281 K282 Y283	E212-D279 PolarHBondContact OE1-N 3.38Å; D279-C281 PolarHBondContact O-N 3.08Å; D279-C281 WeakPolarHBondContact OD1-CB 3.32Å; D279-C281 PolarHBondContact OD1-N 3.46Å; D279-C281 VanDerWaalsContact OD1-N 3.1Å; D279-K282 HydrophobicContact CB-CB 3.87Å; D279-K282 HydrophobicContact CB-CD 4.31Å; D279-K282 WeakPolarHBondContact O-CB 3.43Å; D279-K282 PolarHBondContact O-N 3.34Å; D279-K282 PolarHBondContact OD1-N 3.24Å; D279-K282 WeakPolarHBondContact OD2-CB 3.41Å; D279-Y283 WeakPolarHBondContact O-CD2 3.33Å
280	V	95.9	Very high	93.8	Very high	88 Å²	88	92.7 Å²	92.7	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-58	-35.6	178.7	-178.9	0	0	0	0	112.1	I278 K282 Y283 L284	I278-V280 PolarHBondContact O-N 3.11Å; V280-K282 PolarHBondContact O-N 3.31Å; V280-Y283 PolarHBondContact O-N 2.9Å; V280-L284 HydrophobicContact CG1-CD1 3.94Å; V280-L284 HydrophobicContact CG1-CG 4.48Å; V280-L284 PolarHBondContact O-N 3.31Å
281	C	95.3	Very high	94.1	Very high	100 Å²	100	87.4 Å²	87.4	68%	0.676	49%	0.489	S	S	*	.	H	α-helix	trans	-67.9	-37	-178.1	-68.2	0	0	0	0	111.6	D279 Y283 G285	D279-C281 PolarHBondContact O-N 3.08Å; D279-C281 WeakPolarHBondContact OD1-CB 3.32Å; D279-C281 PolarHBondContact OD1-N 3.46Å; D279-C281 VanDerWaalsContact OD1-N 3.1Å; C281-Y283 PolarHBondContact O-N 3.37Å; C281-G285 VanDerWaalsContact O-CA 3.22Å; C281-G285 WeakPolarHBondContact O-CA 3.11Å; C281-G285 PolarHBondContact O-N 3.29Å
282	K	94.8	Very high	94.3	Very high	97 Å²	97	88.3 Å²	88.3	42%	0.422	48%	0.48	S	S	.	.	H	α-helix	trans	-57.5	-35	173.6	170.3	-172.6	170.8	-164.1	0	113.1	E212 D279 V280 R290	E212-K282 IonicContact OE2-NZ 3.66Å; E212-K282 PolarHBondContact OE2-NZ 2.94Å; D279-K282 HydrophobicContact CB-CB 3.87Å; D279-K282 HydrophobicContact CB-CD 4.31Å; D279-K282 WeakPolarHBondContact O-CB 3.43Å; D279-K282 PolarHBondContact O-N 3.34Å; D279-K282 PolarHBondContact OD1-N 3.24Å; D279-K282 WeakPolarHBondContact OD2-CB 3.41Å; V280-K282 PolarHBondContact O-N 3.31Å; K282-R290 PolarHBondContact O-NH1 3.23Å; K282-R290 PolarHBondContact O-NH2 3.12Å
283	Y	96.1	Very high	94.3	Very high	23 Å²	23	86.7 Å²	86.7	9%	0.09	46%	0.462	C	S	.	.	H	α-helix	trans	-92.7	-43.3	-176.8	-62.8	-73.3	0	0	0	113.6	I205 A208 M209 E212 I278 D279 V280 C281	I205-Y283 HydrophobicContact CG2-CD1 4.12Å; A208-Y283 HydrophobicContact CB-CE1 4.2Å; A208-Y283 PolarHBondContact O-OH 3.35Å; M209-Y283 WeakPolarHBondContact CA-OH 3.36Å; M209-Y283 HydrophobicContact CB-CD1 4Å; M209-Y283 HydrophobicContact CB-CE1 3.68Å; M209-Y283 HydrophobicContact CB-CE2 4.27Å; M209-Y283 HydrophobicContact CB-CG 4.42Å; M209-Y283 HydrophobicContact CG-CD2 4.22Å; M209-Y283 HydrophobicContact CG-CE1 4.38Å; M209-Y283 HydrophobicContact CG-CE2 4.13Å; M209-Y283 HydrophobicContact CG-CG 4.43Å; E212-Y283 WeakPolarHBondContact CB-OH 3.42Å; E212-Y283 WeakPolarHBondContact OE2-CE2 3.22Å; E212-Y283 PolarHBondContact OE2-OH 2.73Å; I278-Y283 HydrophobicContact CG2-CD2 4.39Å; I278-Y283 HydrophobicContact CG2-CE2 4.16Å; D279-Y283 WeakPolarHBondContact O-CD2 3.33Å; V280-Y283 PolarHBondContact O-N 2.9Å; C281-Y283 PolarHBondContact O-N 3.37Å
284	L	96.3	Very high	94.4	Very high	116 Å²	116	87 Å²	87	61%	0.607	46%	0.462	S	S	*	.	H	α-helix	trans	-95.8	-18.4	-176.3	-67.5	-179.3	0	0	0	114.3	V280 S286 L287	V280-L284 HydrophobicContact CG1-CD1 3.94Å; V280-L284 HydrophobicContact CG1-CG 4.48Å; V280-L284 PolarHBondContact O-N 3.31Å; L284-S286 PolarHBondContact O-N 3.24Å; L284-L287 HydrophobicContact CD2-CD2 4.27Å; L284-L287 PolarHBondContact O-N 2.85Å
285	G	95.3	Very high	94.4	Very high	33 Å²	33	82.8 Å²	82.8	34%	0.34	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	111.9	-179	0	0	0	0	0	111.6	C281 L287 R290	C281-G285 VanDerWaalsContact O-CA 3.22Å; C281-G285 WeakPolarHBondContact O-CA 3.11Å; C281-G285 PolarHBondContact O-N 3.29Å; G285-L287 PolarHBondContact O-N 3.13Å; G285-R290 WeakPolarHBondContact O-CD 3.36Å; G285-R290 PolarHBondContact O-NH1 2.82Å; G285-R290 VanDerWaalsContact O-NH1 3.13Å
286	S	95.5	Very high	94.4	Very high	88 Å²	88	82.2 Å²	82.2	62%	0.615	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.8	38.5	-178.4	-57.3	0	0	0	0	113.6	L284 Q288 Y289 R290	L284-S286 PolarHBondContact O-N 3.24Å; S286-Q288 PolarHBondContact O-N 3Å; S286-Y289 PolarHBondContact O-N 3.14Å; S286-Y289 VanDerWaalsContact O-N 3.14Å; S286-R290 WeakPolarHBondContact O-CG 3.34Å; S286-R290 PolarHBondContact O-N 2.92Å
287	L	95.8	Very high	94	Very high	52 Å²	52	84.2 Å²	84.2	27%	0.272	44%	0.442	S	S	.	.	H	α-helix	trans	-53	-51.1	-172.3	172.7	59.4	0	0	0	112.5	I205 L284 G285 Y289 R290 V291	I205-L287 HydrophobicContact CD1-CD1 3.46Å; I205-L287 VanDerWaalsContact CD1-CD1 3.46Å; L284-L287 HydrophobicContact CD2-CD2 4.27Å; L284-L287 PolarHBondContact O-N 2.85Å; G285-L287 PolarHBondContact O-N 3.13Å; L287-Y289 VanDerWaalsContact C-N 3.32Å; L287-Y289 PolarHBondContact O-N 3.39Å; L287-R290 PolarHBondContact O-N 3.29Å; L287-V291 HydrophobicContact CD1-CG2 3.79Å; L287-V291 WeakPolarHBondContact O-CG2 3.2Å; L287-V291 PolarHBondContact O-N 2.99Å
288	Q	95.1	Very high	93.4	Very high	173 Å²	173	81.2 Å²	81.2	81%	0.808	43%	0.433	S	S	*	.	H	α-helix	trans	-57.3	-45	-179.9	-68	-179.7	-13.5	0	0	111.9	S286 W292	S286-Q288 PolarHBondContact O-N 3Å; Q288-W292 VanDerWaalsContact O-CB 3.23Å; Q288-W292 WeakPolarHBondContact O-CB 3.47Å; Q288-W292 PolarHBondContact O-N 3.18Å
289	Y	93.6	Very high	92.9	Very high	78 Å²	78	81 Å²	81	31%	0.306	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-44.3	178	176.4	-109.6	0	0	0	112.1	S286 L287 W292 K293 E489	S286-Y289 PolarHBondContact O-N 3.14Å; S286-Y289 VanDerWaalsContact O-N 3.14Å; L287-Y289 VanDerWaalsContact C-N 3.32Å; L287-Y289 PolarHBondContact O-N 3.39Å; Y289-W292 AromaticContact CD2-CE3 3.89Å; Y289-W292 HydrophobicContact CD2-CE3 3.89Å; Y289-W292 HydrophobicContact CD2-CZ3 4.12Å; Y289-W292 AromaticContact CE2-CE3 3.92Å; Y289-W292 HydrophobicContact CE2-CE3 3.92Å; Y289-W292 AromaticContact CE2-CZ3 3.71Å; Y289-W292 HydrophobicContact CE2-CZ3 3.71Å; Y289-W292 PolarHBondContact O-N 3.11Å; Y289-K293 HydrophobicContact CE1-CD 4Å; Y289-K293 WeakPolarHBondContact O-CB 3.32Å; Y289-K293 PolarHBondContact O-N 3.44Å; Y289-K293 PolarHBondContact OH-NZ 3Å; Y289-E489 PolarHBondContact OH-OE1 2.87Å
290	R	94.1	Very high	92.6	Very high	108 Å²	108	84.2 Å²	84.2	41%	0.408	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-44.9	179	-71.8	163.1	60.3	-166	0.1	112	K282 G285 S286 L287 K293 K294	K282-R290 PolarHBondContact O-NH1 3.23Å; K282-R290 PolarHBondContact O-NH2 3.12Å; G285-R290 WeakPolarHBondContact O-CD 3.36Å; G285-R290 PolarHBondContact O-NH1 2.82Å; G285-R290 VanDerWaalsContact O-NH1 3.13Å; S286-R290 WeakPolarHBondContact O-CG 3.34Å; S286-R290 PolarHBondContact O-N 2.92Å; L287-R290 PolarHBondContact O-N 3.29Å; R290-K293 PolarHBondContact O-N 2.9Å; R290-K294 WeakPolarHBondContact O-CG 3.37Å; R290-K294 PolarHBondContact O-N 2.89Å
291	V	95.7	Very high	92.3	Very high	19 Å²	19	82.2 Å²	82.2	12%	0.115	44%	0.437	C	S	.	.	H	α-helix	trans	-65.8	-46.4	177.6	174.1	0	0	0	0	110.4	F197 L198 E201 I205 L287 K293 K294 M295	F197-V291 HydrophobicContact CE1-CG1 4.12Å; L198-V291 HydrophobicContact CD2-CG1 3.77Å; E201-V291 HydrophobicContact CB-CG1 4.36Å; I205-V291 HydrophobicContact CD1-CG2 4.14Å; L287-V291 HydrophobicContact CD1-CG2 3.79Å; L287-V291 WeakPolarHBondContact O-CG2 3.2Å; L287-V291 PolarHBondContact O-N 2.99Å; V291-K293 PolarHBondContact O-N 3.44Å; V291-K294 PolarHBondContact O-N 3.22Å; V291-M295 PolarHBondContact O-N 2.67Å
292	W	93.4	Very high	92.2	Very high	123 Å²	123	78.8 Å²	78.8	47%	0.466	41%	0.413	S	S	.	.	H	α-helix	trans	-60.1	-43.6	175.8	172.4	80.4	0	0	0	112.6	Q288 Y289 K294 M295 L296 I487	Q288-W292 VanDerWaalsContact O-CB 3.23Å; Q288-W292 WeakPolarHBondContact O-CB 3.47Å; Q288-W292 PolarHBondContact O-N 3.18Å; Y289-W292 AromaticContact CD2-CE3 3.89Å; Y289-W292 HydrophobicContact CD2-CE3 3.89Å; Y289-W292 HydrophobicContact CD2-CZ3 4.12Å; Y289-W292 AromaticContact CE2-CE3 3.92Å; Y289-W292 HydrophobicContact CE2-CE3 3.92Å; Y289-W292 AromaticContact CE2-CZ3 3.71Å; Y289-W292 HydrophobicContact CE2-CZ3 3.71Å; Y289-W292 PolarHBondContact O-N 3.11Å; W292-K294 VanDerWaalsContact C-N 3.33Å; W292-K294 PolarHBondContact O-N 3.17Å; W292-M295 WeakPolarHBondContact O-CA 3.47Å; W292-M295 VanDerWaalsContact O-CB 3.25Å; W292-M295 WeakPolarHBondContact O-CB 3.48Å; W292-M295 PolarHBondContact O-N 3.41Å; W292-M295 VanDerWaalsContact O-N 3.09Å; W292-L296 PolarHBondContact O-N 3.14Å; W292-I487 HydrophobicContact CH2-CD1 3.79Å; W292-I487 HydrophobicContact CH2-CG1 4.15Å; W292-I487 HydrophobicContact CZ3-CD1 3.54Å; W292-I487 HydrophobicContact CZ3-CG1 4.32Å
293	K	92	Very high	92.2	Very high	96 Å²	96	75 Å²	75	42%	0.417	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-38.1	177.8	-174.8	171.2	-170.8	164	0	112.1	Y289 R290 V291 L296 I487 E489	Y289-K293 HydrophobicContact CE1-CD 4Å; Y289-K293 WeakPolarHBondContact O-CB 3.32Å; Y289-K293 PolarHBondContact O-N 3.44Å; Y289-K293 PolarHBondContact OH-NZ 3Å; R290-K293 PolarHBondContact O-N 2.9Å; V291-K293 PolarHBondContact O-N 3.44Å; K293-L296 WeakPolarHBondContact O-CB 3.42Å; K293-L296 PolarHBondContact O-N 3.17Å; K293-I487 HydrophobicContact CD-CD1 4.46Å; K293-I487 HydrophobicContact CG-CD1 4.02Å; K293-E489 IonicContact NZ-OE1 3.26Å; K293-E489 PolarHBondContact NZ-OE1 2.9Å
294	K	92.4	Very high	92.3	Very high	109 Å²	109	74 Å²	74	47%	0.474	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-42.3	171.2	-75.1	-179.5	173.9	-170	0	111.8	F197 E201 R290 V291 W292 L296 A297	F197-K294 HydrophobicContact CZ-CB 3.95Å; E201-K294 IonicContact OE1-NZ 3.76Å; E201-K294 PolarHBondContact OE1-NZ 3Å; E201-K294 VanDerWaalsContact OE2-CD 3.22Å; E201-K294 WeakPolarHBondContact OE2-CD 3.46Å; E201-K294 IonicContact OE2-NZ 3.3Å; E201-K294 PolarHBondContact OE2-NZ 3.04Å; R290-K294 WeakPolarHBondContact O-CG 3.37Å; R290-K294 PolarHBondContact O-N 2.89Å; V291-K294 PolarHBondContact O-N 3.22Å; W292-K294 VanDerWaalsContact C-N 3.33Å; W292-K294 PolarHBondContact O-N 3.17Å; K294-L296 PolarHBondContact O-N 2.99Å; K294-A297 WeakPolarHBondContact O-CB 3.22Å; K294-A297 PolarHBondContact O-N 3.27Å
295	M	91.6	Very high	92.3	Very high	34 Å²	34	70 Å²	70	17%	0.167	38%	0.376	C	S	.	.	H	α-helix	trans	-57.6	-35.3	178.6	-164.2	-173.4	-51	0	0	111.6	L194 F197 L198 V291 W292 A297 S298 V299	L194-M295 HydrophobicContact CD2-CG 4.43Å; L194-M295 HydrophobicContact CD2-SD 4.13Å; F197-M295 HydrophobicContact CD1-CB 4.05Å; F197-M295 HydrophobicContact CD1-CE 3.96Å; F197-M295 HydrophobicContact CD1-CG 3.76Å; F197-M295 HydrophobicContact CD1-SD 4.48Å; F197-M295 HydrophobicContact CE1-CB 3.47Å; F197-M295 VanDerWaalsContact CE1-CB 3.47Å; F197-M295 HydrophobicContact CE1-CE 3.97Å; F197-M295 HydrophobicContact CE1-CG 3.74Å; F197-M295 HydrophobicContact CG-CG 4.38Å; F197-M295 VanDerWaalsContact CZ-CA 3.44Å; F197-M295 HydrophobicContact CZ-CB 3.82Å; F197-M295 HydrophobicContact CZ-CG 4.33Å; L198-M295 HydrophobicContact CD2-CE 3.53Å; L198-M295 HydrophobicContact CG-CE 4.03Å; V291-M295 PolarHBondContact O-N 2.67Å; W292-M295 WeakPolarHBondContact O-CA 3.47Å; W292-M295 VanDerWaalsContact O-CB 3.25Å; W292-M295 WeakPolarHBondContact O-CB 3.48Å; W292-M295 PolarHBondContact O-N 3.41Å; W292-M295 VanDerWaalsContact O-N 3.09Å; M295-A297 PolarHBondContact O-N 3.26Å; M295-S298 WeakPolarHBondContact O-CA 3.42Å; M295-S298 WeakPolarHBondContact O-CB 3.42Å; M295-S298 PolarHBondContact O-N 3.38Å; M295-V299 HydrophobicContact CG-CG2 4.45Å; M295-V299 WeakPolarHBondContact O-CG2 3.2Å; M295-V299 PolarHBondContact O-N 2.83Å
296	L	89.3	Confident	92.4	Very high	40 Å²	40	68.5 Å²	68.5	21%	0.209	36%	0.36	C	S	.	.	H	α-helix	trans	-56.5	-34.7	176.8	-169.8	65.2	0	0	0	112.9	W292 K293 K294 S298 V299 I485 I487	W292-L296 PolarHBondContact O-N 3.14Å; K293-L296 WeakPolarHBondContact O-CB 3.42Å; K293-L296 PolarHBondContact O-N 3.17Å; K294-L296 PolarHBondContact O-N 2.99Å; L296-S298 PolarHBondContact O-N 3.15Å; L296-V299 PolarHBondContact O-N 2.99Å; L296-I485 HydrophobicContact CD1-CB 4.37Å; L296-I485 HydrophobicContact CD1-CD1 3.76Å; L296-I485 HydrophobicContact CD1-CG2 4.06Å; L296-I485 HydrophobicContact CD2-CB 4.32Å; L296-I485 HydrophobicContact CD2-CG2 3.89Å; L296-I485 HydrophobicContact CG-CG2 4.39Å; L296-I487 HydrophobicContact CD2-CD1 3.61Å; L296-I487 HydrophobicContact CD2-CG1 3.83Å
297	A	84.8	Confident	92.4	Very high	97 Å²	97	65.4 Å²	65.4	80%	0.802	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.7	176.8	0	0	0	0	0	113.3	K294 M295	K294-A297 WeakPolarHBondContact O-CB 3.22Å; K294-A297 PolarHBondContact O-N 3.27Å; M295-A297 PolarHBondContact O-N 3.26Å
298	S	83.5	Confident	92.2	Very high	83 Å²	83	65.1 Å²	65.1	58%	0.58	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-2.5	178.2	-54.5	0	0	0	0	113.3	M295 L296	M295-S298 WeakPolarHBondContact O-CA 3.42Å; M295-S298 WeakPolarHBondContact O-CB 3.42Å; M295-S298 PolarHBondContact O-N 3.38Å; L296-S298 PolarHBondContact O-N 3.15Å
299	V	85.8	Confident	92	Very high	65 Å²	65	60.6 Å²	60.6	39%	0.394	32%	0.319	S	S	.	.			trans	-108.2	120.4	179.9	177.3	0	0	0	0	109.4	L194 M295 L296	L194-V299 HydrophobicContact CD2-CG2 4.14Å; M295-V299 HydrophobicContact CG-CG2 4.45Å; M295-V299 WeakPolarHBondContact O-CG2 3.2Å; M295-V299 PolarHBondContact O-N 2.83Å; L296-V299 PolarHBondContact O-N 2.99Å
300	E	87.6	Confident	91.9	Very high	146 Å²	146	57 Å²	57	68%	0.682	31%	0.305	S	S	*	.			trans	-86.9	135.4	170.1	-65.7	-176.8	-177.6	0	0	109.8
301	S	90.9	Very high	91.8	Very high	47 Å²	47	52 Å²	52	33%	0.329	29%	0.287	S	S	.	.			trans	-124.7	138.3	174.7	-173.8	0	0	0	0	109.4	P482 L483	S301-P482 CarbonylContact O-C 3.56Å; S301-P482 VanDerWaalsContact O-CA 3.26Å; S301-P482 WeakPolarHBondContact O-CA 3.03Å; S301-L483 PolarHBondContact O-N 3.1Å
302	V	93.8	Very high	91.5	Very high	28 Å²	28	51 Å²	51	17%	0.17	28%	0.281	C	S	.	.			trans	-118	151.4	175.2	-71.3	0	0	0	0	109.7	F304 T322 I480	V302-F304 WeakPolarHBondContact CG2-O 3.21Å; V302-F304 PolarHBondContact O-N 3.49Å; V302-T322 HydrophobicContact CG1-CG2 3.77Å; V302-T322 HydrophobicContact CG2-CG2 4.07Å; V302-I480 HydrophobicContact CB-CG2 4.08Å; V302-I480 HydrophobicContact CG1-CB 4.5Å; V302-I480 HydrophobicContact CG1-CG2 4.12Å
303	P	94.8	Very high	91.1	Very high	17 Å²	17	45.9 Å²	45.9	11%	0.11	27%	0.266	C	S	.	.	S	Bend	trans	-63.6	-28.6	-178.3	22.8	-31.1	0	0	0	112.9	R349 W358 I480 L483	P303-R349 WeakPolarHBondContact O-CD 3.43Å; P303-R349 PolarHBondContact O-NE 2.9Å; P303-R349 PolarHBondContact O-NH1 2.86Å; P303-W358 HydrophobicContact CB-CB 4.29Å; P303-W358 HydrophobicContact CG-CB 3.49Å; P303-W358 VanDerWaalsContact CG-CB 3.49Å; P303-I480 HydrophobicContact CG-CG2 4.11Å; P303-L483 HydrophobicContact CB-CD1 4.49Å; P303-L483 HydrophobicContact CB-CD2 4.19Å; P303-L483 HydrophobicContact CG-CD2 4.24Å
304	F	96.6	Very high	90.7	Very high	3 Å²	3	44.8 Å²	44.8	1%	0.013	26%	0.259	C	S	.	.			trans	-162.1	174.3	172.7	54.3	-92.8	0	0	0	108.8	V302 R349 F351 W358 P462 F464 I480	V302-F304 WeakPolarHBondContact CG2-O 3.21Å; V302-F304 PolarHBondContact O-N 3.49Å; F304-R349 HydrophobicContact CB-CB 4.07Å; F304-R349 HydrophobicContact CB-CG 3.79Å; F304-F351 HydrophobicContact CD1-CE2 4.32Å; F304-F351 AromaticContact CD1-CZ 3.96Å; F304-F351 HydrophobicContact CD1-CZ 3.96Å; F304-F351 HydrophobicContact CE1-CE2 4.43Å; F304-F351 HydrophobicContact CE1-CZ 4.41Å; F304-W358 HydrophobicContact CE1-CB 3.95Å; F304-W358 AromaticContact CE1-CD1 3.94Å; F304-W358 AromaticContact CE1-CD2 3.62Å; F304-W358 HydrophobicContact CE1-CD2 3.62Å; F304-W358 HydrophobicContact CE1-CE3 4.06Å; F304-W358 AromaticContact CE1-CG 3.57Å; F304-W358 HydrophobicContact CE1-CG 3.57Å; F304-W358 HydrophobicContact CZ-CB 4.43Å; F304-W358 AromaticContact CZ-CD1 3.67Å; F304-W358 HydrophobicContact CZ-CD2 4.01Å; F304-W358 AromaticContact CZ-CE2 3.98Å; F304-W358 AromaticContact CZ-CG 3.8Å; F304-W358 HydrophobicContact CZ-CG 3.8Å; F304-W358 AromaticContact CZ-NE1 3.77Å; F304-P462 HydrophobicContact CD1-CG 3.97Å; F304-P462 HydrophobicContact CD2-CB 4.35Å; F304-P462 HydrophobicContact CD2-CG 4.1Å; F304-P462 HydrophobicContact CE1-CB 4.2Å; F304-P462 HydrophobicContact CE1-CG 3.62Å; F304-P462 HydrophobicContact CE2-CB 3.66Å; F304-P462 HydrophobicContact CE2-CG 3.77Å; F304-P462 HydrophobicContact CG-CG 4.21Å; F304-P462 HydrophobicContact CZ-CB 3.57Å; F304-P462 HydrophobicContact CZ-CG 3.52Å; F304-F464 AromaticContact CE2-CE2 3.8Å; F304-F464 HydrophobicContact CE2-CE2 3.8Å; F304-F464 AromaticContact CE2-CZ 3.62Å; F304-F464 HydrophobicContact CE2-CZ 3.62Å; F304-F464 HydrophobicContact CZ-CE2 4.3Å; F304-F464 AromaticContact CZ-CZ 3.77Å; F304-F464 HydrophobicContact CZ-CZ 3.77Å; F304-I480 HydrophobicContact CD2-CD1 3.75Å; F304-I480 HydrophobicContact CE2-CD1 3.52Å; F304-I480 HydrophobicContact CE2-CG1 4.24Å; F304-I480 HydrophobicContact CZ-CD1 4.4Å; F304-I480 WeakPolarHBondContact O-CD1 3.25Å
305	S	96.9	Very high	90.6	Very high	31 Å²	31	39.7 Å²	39.7	22%	0.217	24%	0.238	C	C	.	.			trans	-113.3	162.4	177.9	-57.6	0	0	0	0	110.4	L321 G347 S348	S305-L321 CarbonylContact C-O 3.56Å; S305-L321 WeakPolarHBondContact CA-O 3.4Å; S305-G347 CarbonylContact O-C 3.58Å; S305-G347 VanDerWaalsContact O-CA 3.31Å; S305-G347 WeakPolarHBondContact O-CA 3.22Å; S305-S348 PolarHBondContact N-OG 3.28Å; S305-S348 VanDerWaalsContact N-OG 3.12Å; S305-S348 WeakPolarHBondContact O-CB 3.44Å; S305-S348 PolarHBondContact O-N 3.47Å; S305-S348 PolarHBondContact O-OG 3.36Å
306	F	97.3	Very high	90.5	Very high	1 Å²	1	39.2 Å²	39.2	0%	0.004	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-70.5	144.1	165.5	-68.4	-57.9	0	0	0	110.7	P308 V317 L321 T322 V324 L345 F464 L478 I480	F306-P308 WeakPolarHBondContact O-CD 3.27Å; F306-V317 HydrophobicContact CB-CG1 3.78Å; F306-V317 HydrophobicContact CB-CG2 4.2Å; F306-L321 PolarHBondContact N-O 2.85Å; F306-T322 VanDerWaalsContact CE2-C 3.49Å; F306-T322 VanDerWaalsContact CE2-O 3.24Å; F306-T322 WeakPolarHBondContact CE2-O 3.22Å; F306-V324 HydrophobicContact CD2-CB 4.28Å; F306-V324 HydrophobicContact CD2-CG1 4.27Å; F306-V324 HydrophobicContact CE1-CG1 4.31Å; F306-V324 HydrophobicContact CE2-CB 4.27Å; F306-V324 HydrophobicContact CE2-CG1 3.84Å; F306-V324 HydrophobicContact CZ-CG1 3.88Å; F306-L345 HydrophobicContact CB-CD1 3.81Å; F306-L345 HydrophobicContact CD1-CD1 3.68Å; F306-L345 HydrophobicContact CD1-CG 4.02Å; F306-L345 HydrophobicContact CE1-CD1 4.48Å; F306-L345 HydrophobicContact CG-CD1 3.82Å; F306-F464 AromaticContact CD1-CD2 3.99Å; F306-F464 HydrophobicContact CD1-CD2 3.99Å; F306-F464 HydrophobicContact CD1-CE2 4.09Å; F306-F464 HydrophobicContact CE1-CB 4.37Å; F306-F464 AromaticContact CE1-CD1 3.99Å; F306-F464 HydrophobicContact CE1-CD1 3.99Å; F306-F464 AromaticContact CE1-CD2 3.47Å; F306-F464 HydrophobicContact CE1-CD2 3.47Å; F306-F464 VanDerWaalsContact CE1-CD2 3.47Å; F306-F464 HydrophobicContact CE1-CE1 4.08Å; F306-F464 AromaticContact CE1-CE2 3.54Å; F306-F464 HydrophobicContact CE1-CE2 3.54Å; F306-F464 AromaticContact CE1-CG 3.68Å; F306-F464 HydrophobicContact CE1-CG 3.68Å; F306-F464 AromaticContact CE1-CZ 3.87Å; F306-F464 HydrophobicContact CE1-CZ 3.87Å; F306-F464 HydrophobicContact CZ-CD1 4.47Å; F306-F464 HydrophobicContact CZ-CE1 4.48Å; F306-L478 HydrophobicContact CE1-CD2 4.27Å; F306-L478 HydrophobicContact CE2-CD2 4.39Å; F306-L478 HydrophobicContact CZ-CD2 3.52Å; F306-I480 HydrophobicContact CD1-CD1 4.26Å; F306-I480 HydrophobicContact CD2-CD1 4.12Å; F306-I480 HydrophobicContact CE1-CD1 3.98Å; F306-I480 HydrophobicContact CE1-CG1 4.17Å; F306-I480 HydrophobicContact CE2-CD1 3.86Å; F306-I480 HydrophobicContact CE2-CG1 3.81Å; F306-I480 HydrophobicContact CG-CD1 4.31Å; F306-I480 HydrophobicContact CZ-CD1 3.76Å; F306-I480 HydrophobicContact CZ-CG1 3.56Å
307	D	94.8	Very high	90.7	Very high	24 Å²	24	38.5 Å²	38.5	13%	0.128	24%	0.235	C	C	.	.			trans	-98.5	106.3	177.2	-177.5	-8.6	0	0	0	110.8	N309 T310 A311 L346 R461	D307-N309 PolarHBondContact O-N 3.1Å; D307-N309 WeakPolarHBondContact OD1-CB 3.36Å; D307-N309 PolarHBondContact OD1-N 3.02Å; D307-T310 HydrophobicContact CB-CG2 4.17Å; D307-T310 PolarHBondContact O-N 3.14Å; D307-T310 PolarHBondContact O-OG1 3.25Å; D307-T310 WeakPolarHBondContact OD2-CG2 3.3Å; D307-A311 PolarHBondContact O-N 2.97Å; D307-L346 WeakPolarHBondContact CB-O 3.44Å; D307-L346 PolarHBondContact N-O 3.4Å; D307-R461 IonicContact OD2-CZ 3.09Å; D307-R461 IonicContact OD2-NH1 3.33Å; D307-R461 IonicContact OD2-NH2 2.67Å; D307-R461 PolarHBondContact OD2-NH2 2.88Å
308	P	92.6	Very high	91.1	Very high	46 Å²	46	35.4 Å²	35.4	30%	0.299	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.7	-179.1	-22.3	34.9	0	0	0	114	F306 T310 A311 V317 L321	F306-P308 WeakPolarHBondContact O-CD 3.27Å; P308-T310 VanDerWaalsContact C-N 3.25Å; P308-T310 PolarHBondContact O-N 3.47Å; P308-A311 PolarHBondContact O-N 3.33Å; P308-V317 HydrophobicContact CG-CB 4.39Å; P308-V317 HydrophobicContact CG-CG1 4.46Å; P308-V317 HydrophobicContact CG-CG2 4.43Å; P308-L321 HydrophobicContact CG-CD2 3.86Å
309	N	91.2	Very high	91.4	Very high	77 Å²	77	35.6 Å²	35.6	41%	0.412	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-25.6	-179.2	-69.1	-29.3	0	0	0	112.3	D307 N335	D307-N309 PolarHBondContact O-N 3.1Å; D307-N309 WeakPolarHBondContact OD1-CB 3.36Å; D307-N309 PolarHBondContact OD1-N 3.02Å; N309-N335 PolarHBondContact O-ND2 3.12Å
310	T	91.9	Very high	91.7	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.018	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-21.1	177.3	68.6	0	0	0	0	112.4	D307 P308 A312 E337 F339 L346	D307-T310 HydrophobicContact CB-CG2 4.17Å; D307-T310 PolarHBondContact O-N 3.14Å; D307-T310 PolarHBondContact O-OG1 3.25Å; D307-T310 WeakPolarHBondContact OD2-CG2 3.3Å; P308-T310 VanDerWaalsContact C-N 3.25Å; P308-T310 PolarHBondContact O-N 3.47Å; T310-A312 PolarHBondContact O-N 3.22Å; T310-E337 WeakPolarHBondContact CA-O 3.37Å; T310-F339 WeakPolarHBondContact O-CD2 3.35Å; T310-F339 PolarHBondContact O-N 3.4Å; T310-F339 VanDerWaalsContact O-N 3.11Å; T310-L346 HydrophobicContact CG2-CB 4.09Å; T310-L346 HydrophobicContact CG2-CD1 4.07Å; T310-L346 HydrophobicContact CG2-CG 4.1Å; T310-L346 PolarHBondContact OG1-N 2.83Å
311	A	91.3	Very high	92	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.017	18%	0.183	C	C	.	.	S	Bend	trans	-66.1	132.2	-169.6	0	0	0	0	0	112.3	D307 P308 L315 V317 R338 L345	D307-A311 PolarHBondContact O-N 2.97Å; P308-A311 PolarHBondContact O-N 3.33Å; A311-L315 HydrophobicContact CB-CB 4.42Å; A311-V317 HydrophobicContact CB-CG2 4.32Å; A311-R338 WeakPolarHBondContact O-CG 3.39Å; A311-R338 PolarHBondContact O-NH1 3.25Å; A311-L345 HydrophobicContact CB-CB 3.79Å; A311-L345 HydrophobicContact CB-CD1 4.2Å
312	A	89.1	Confident	92.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.			trans	-57.7	148.4	175.1	0	0	0	0	0	112.5	T310 W314 L315 F339 A342 C344	T310-A312 PolarHBondContact O-N 3.22Å; A312-W314 HydrophobicContact CB-CZ2 4.24Å; A312-W314 PolarHBondContact O-N 3.28Å; A312-L315 HydrophobicContact CB-CD1 4.37Å; A312-L315 HydrophobicContact CB-CG 4.37Å; A312-L315 WeakPolarHBondContact O-CB 3.46Å; A312-L315 PolarHBondContact O-N 2.98Å; A312-F339 VanDerWaalsContact CA-O 3.22Å; A312-F339 WeakPolarHBondContact CA-O 3.45Å; A312-F339 HydrophobicContact CB-CB 4.25Å; A312-F339 VanDerWaalsContact CB-O 3.27Å; A312-F339 WeakPolarHBondContact CB-O 3.4Å; A312-A342 WeakPolarHBondContact CB-O 3.22Å; A312-C344 PolarHBondContact N-O 3.26Å
313	G	85.3	Confident	92.3	Very high	14 Å²	14	28.8 Å²	28.8	14%	0.144	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.9	-170.7	0	0	0	0	0	116.4	R330	G313-R330 PolarHBondContact O-N 2.97Å
314	W	84.1	Confident	92.3	Very high	73 Å²	73	28 Å²	28	28%	0.277	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	5.5	174	47.5	63.5	0	0	0	113.9	A312 N326 H327 G328	A312-W314 HydrophobicContact CB-CZ2 4.24Å; A312-W314 PolarHBondContact O-N 3.28Å; W314-N326 PolarHBondContact O-OD1 2.94Å; W314-H327 PolarHBondContact O-N 3.38Å; W314-G328 WeakPolarHBondContact CA-O 3.39Å
315	L	89.6	Confident	92	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	145.8	172.1	-61.1	-177.3	0	0	0	110.7	A311 A312 V324 T325 N326 P343 L345 L466	A311-L315 HydrophobicContact CB-CB 4.42Å; A312-L315 HydrophobicContact CB-CD1 4.37Å; A312-L315 HydrophobicContact CB-CG 4.37Å; A312-L315 WeakPolarHBondContact O-CB 3.46Å; A312-L315 PolarHBondContact O-N 2.98Å; L315-V324 HydrophobicContact CB-CG2 4.03Å; L315-V324 HydrophobicContact CD1-CG2 4.3Å; L315-V324 HydrophobicContact CD2-CG2 4.37Å; L315-V324 HydrophobicContact CG-CG2 4.48Å; L315-T325 WeakPolarHBondContact CA-O 3.41Å; L315-N326 HydrophobicContact CD2-CB 3.89Å; L315-P343 HydrophobicContact CD2-CB 4.08Å; L315-P343 HydrophobicContact CG-CB 4.48Å; L315-L345 HydrophobicContact CD1-CB 4.27Å; L315-L345 HydrophobicContact CD1-CD2 3.91Å; L315-L466 HydrophobicContact CD2-CB 4.22Å
316	S	90.2	Very high	91.6	Very high	24 Å²	24	28.7 Å²	28.7	17%	0.168	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.8	171.6	-164.9	0	0	0	0	108.7	V324 T325	S316-V324 VanDerWaalsContact O-CA 3.32Å; S316-V324 WeakPolarHBondContact O-CA 3.42Å; S316-T325 PolarHBondContact N-O 3.44Å; S316-T325 PolarHBondContact O-N 3.42Å; S316-T325 PolarHBondContact O-OG1 2.89Å
317	V	92.4	Very high	90.6	Very high	25 Å²	25	34 Å²	34	15%	0.152	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	140.8	171.6	-176.9	0	0	0	0	108.1	F306 P308 A311 L321 S323 L345	F306-V317 HydrophobicContact CB-CG1 3.78Å; F306-V317 HydrophobicContact CB-CG2 4.2Å; P308-V317 HydrophobicContact CG-CB 4.39Å; P308-V317 HydrophobicContact CG-CG1 4.46Å; P308-V317 HydrophobicContact CG-CG2 4.43Å; A311-V317 HydrophobicContact CB-CG2 4.32Å; V317-L321 HydrophobicContact CG1-CB 4.38Å; V317-L321 HydrophobicContact CG1-CD2 3.81Å; V317-S323 CarbonylContact C-O 3.49Å; V317-S323 WeakPolarHBondContact CA-O 3.37Å; V317-L345 HydrophobicContact CG2-CD1 3.91Å
318	S	92.9	Very high	89.2	Confident	32 Å²	32	34.4 Å²	34.4	22%	0.224	20%	0.195	C	C	.	.			trans	-68.9	159.1	174.4	56.1	0	0	0	0	111.3	D320 L321 T322 S323	S318-D320 VanDerWaalsContact CB-OD1 3.28Å; S318-D320 WeakPolarHBondContact CB-OD1 3.14Å; S318-D320 PolarHBondContact O-N 3.11Å; S318-D320 PolarHBondContact OG-OD1 3.25Å; S318-L321 WeakPolarHBondContact O-CA 3.34Å; S318-L321 PolarHBondContact O-N 3.35Å; S318-T322 PolarHBondContact OG-N 2.92Å; S318-S323 PolarHBondContact N-O 2.95Å; S318-S323 WeakPolarHBondContact OG-CA 3.33Å; S318-S323 WeakPolarHBondContact OG-CB 3.46Å; S318-S323 PolarHBondContact OG-N 2.69Å; S318-S323 PolarHBondContact OG-O 2.96Å; S318-S323 VanDerWaalsContact OG-O 3.13Å
319	D	90.6	Very high	87.7	Confident	86 Å²	86	40 Å²	40	46%	0.46	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.2	-175.3	-56.5	-20.5	0	0	0	114.7	W182 R186	W182-D319 HydrophobicContact CH2-CB 4.46Å; W182-D319 HydrophobicContact CZ2-CB 4.07Å; R186-D319 IonicContact CZ-OD2 2.69Å; R186-D319 IonicContact NE-OD2 3.76Å; R186-D319 IonicContact NH1-OD2 3.79Å; R186-D319 IonicContact NH2-OD2 2.82Å; R186-D319 PolarHBondContact NH2-OD2 3.18Å
320	D	91.1	Very high	86.5	Confident	70 Å²	70	43.4 Å²	43.4	37%	0.374	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.1	173.3	65.7	-7.7	0	0	0	112.1	S318 T322 R479	S318-D320 VanDerWaalsContact CB-OD1 3.28Å; S318-D320 WeakPolarHBondContact CB-OD1 3.14Å; S318-D320 PolarHBondContact O-N 3.11Å; S318-D320 PolarHBondContact OG-OD1 3.25Å; D320-T322 HydrophobicContact CB-CG2 4.2Å; D320-T322 WeakPolarHBondContact O-CG2 3.48Å; D320-T322 PolarHBondContact O-N 3.49Å; D320-T322 VanDerWaalsContact O-N 3.15Å; D320-T322 PolarHBondContact OD1-N 3.37Å; D320-T322 VanDerWaalsContact OD1-N 3.09Å; D320-T322 PolarHBondContact OD1-OG1 2.87Å; D320-T322 VanDerWaalsContact OD1-OG1 3.08Å; D320-T322 PolarHBondContact OD2-OG1 3.31Å; D320-R479 IonicContact OD2-NH1 3.31Å
321	L	94.8	Very high	84.9	Confident	58 Å²	58	49.2 Å²	49.2	30%	0.304	25%	0.253	S	S	.	.	S	Bend	trans	59.3	18.4	-178.2	-48.4	175.6	0	0	0	114.3	S305 F306 P308 V317 S318	S305-L321 CarbonylContact C-O 3.56Å; S305-L321 WeakPolarHBondContact CA-O 3.4Å; F306-L321 PolarHBondContact N-O 2.85Å; P308-L321 HydrophobicContact CG-CD2 3.86Å; V317-L321 HydrophobicContact CG1-CB 4.38Å; V317-L321 HydrophobicContact CG1-CD2 3.81Å; S318-L321 WeakPolarHBondContact O-CA 3.34Å; S318-L321 PolarHBondContact O-N 3.35Å
322	T	95.9	Very high	83.7	Confident	11 Å²	11	52.1 Å²	52.1	7%	0.067	27%	0.267	C	S	.	.	S	Bend	trans	-99.5	-12.9	-178	73.7	0	0	0	0	113.5	V302 F306 S318 D320 R479 I480	V302-T322 HydrophobicContact CG1-CG2 3.77Å; V302-T322 HydrophobicContact CG2-CG2 4.07Å; F306-T322 VanDerWaalsContact CE2-C 3.49Å; F306-T322 VanDerWaalsContact CE2-O 3.24Å; F306-T322 WeakPolarHBondContact CE2-O 3.22Å; S318-T322 PolarHBondContact OG-N 2.92Å; D320-T322 HydrophobicContact CB-CG2 4.2Å; D320-T322 WeakPolarHBondContact O-CG2 3.48Å; D320-T322 PolarHBondContact O-N 3.49Å; D320-T322 VanDerWaalsContact O-N 3.15Å; D320-T322 PolarHBondContact OD1-N 3.37Å; D320-T322 VanDerWaalsContact OD1-N 3.09Å; D320-T322 PolarHBondContact OD1-OG1 2.87Å; D320-T322 VanDerWaalsContact OD1-OG1 3.08Å; D320-T322 PolarHBondContact OD2-OG1 3.31Å; T322-R479 CarbonylContact O-C 3.59Å; T322-R479 WeakPolarHBondContact O-CA 3.46Å; T322-R479 PolarHBondContact OG1-NH1 3.45Å; T322-I480 PolarHBondContact O-N 2.95Å
323	S	95.3	Very high	83.4	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.028	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	153.7	-174.7	-54.7	0	0	0	0	111.9	V317 S318 L478 R479	V317-S323 CarbonylContact C-O 3.49Å; V317-S323 WeakPolarHBondContact CA-O 3.37Å; S318-S323 PolarHBondContact N-O 2.95Å; S318-S323 WeakPolarHBondContact OG-CA 3.33Å; S318-S323 WeakPolarHBondContact OG-CB 3.46Å; S318-S323 PolarHBondContact OG-N 2.69Å; S318-S323 PolarHBondContact OG-O 2.96Å; S318-S323 VanDerWaalsContact OG-O 3.13Å; S323-L478 CarbonylContact C-O 3.24Å; S323-L478 VanDerWaalsContact CA-O 3.27Å; S323-L478 WeakPolarHBondContact CA-O 3.47Å; S323-R479 WeakPolarHBondContact OG-CB 3.19Å; S323-R479 WeakPolarHBondContact OG-CG 3.14Å; S323-R479 PolarHBondContact OG-NE 3.24Å; S323-R479 VanDerWaalsContact OG-NE 3.08Å; S323-R479 PolarHBondContact OG-NH1 3.38Å; S323-R479 PolarHBondContact OG-NH2 2.84Å
324	V	94	Very high	83.2	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.1	175.9	56	0	0	0	0	110.4	F306 L315 S316 L345 L466 P477 L478	F306-V324 HydrophobicContact CD2-CB 4.28Å; F306-V324 HydrophobicContact CD2-CG1 4.27Å; F306-V324 HydrophobicContact CE1-CG1 4.31Å; F306-V324 HydrophobicContact CE2-CB 4.27Å; F306-V324 HydrophobicContact CE2-CG1 3.84Å; F306-V324 HydrophobicContact CZ-CG1 3.88Å; L315-V324 HydrophobicContact CB-CG2 4.03Å; L315-V324 HydrophobicContact CD1-CG2 4.3Å; L315-V324 HydrophobicContact CD2-CG2 4.37Å; L315-V324 HydrophobicContact CG-CG2 4.48Å; S316-V324 VanDerWaalsContact O-CA 3.32Å; S316-V324 WeakPolarHBondContact O-CA 3.42Å; V324-L345 HydrophobicContact CB-CD1 4.09Å; V324-L345 HydrophobicContact CG1-CD1 4.33Å; V324-L345 HydrophobicContact CG1-CD2 4.18Å; V324-L345 HydrophobicContact CG2-CD1 3.87Å; V324-L345 HydrophobicContact CG2-CD2 4.26Å; V324-L466 HydrophobicContact CG1-CD1 3.45Å; V324-L466 VanDerWaalsContact CG1-CD1 3.45Å; V324-L466 HydrophobicContact CG1-CD2 3.83Å; V324-L466 HydrophobicContact CG1-CG 4.29Å; V324-L466 HydrophobicContact CG2-CD1 4.35Å; V324-L466 HydrophobicContact CG2-CD2 4.44Å; V324-L466 VanDerWaalsContact O-CD2 3.27Å; V324-L466 WeakPolarHBondContact O-CD2 3.28Å; V324-P477 WeakPolarHBondContact O-CA 3.46Å; V324-L478 HydrophobicContact CG1-CB 4.04Å; V324-L478 HydrophobicContact CG1-CD2 4.21Å; V324-L478 PolarHBondContact N-O 3.11Å; V324-L478 PolarHBondContact O-N 3.35Å
325	T	91.8	Very high	83.3	Confident	22 Å²	22	57.3 Å²	57.3	14%	0.135	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	155.3	176.9	49.9	0	0	0	0	110.6	L315 S316 H327 P477	L315-T325 WeakPolarHBondContact CA-O 3.41Å; S316-T325 PolarHBondContact N-O 3.44Å; S316-T325 PolarHBondContact O-N 3.42Å; S316-T325 PolarHBondContact O-OG1 2.89Å; T325-H327 WeakPolarHBondContact CB-NE2 3.49Å; T325-H327 PolarHBondContact OG1-CD2 3.48Å; T325-H327 PolarHBondContact OG1-NE2 3.18Å; T325-P477 HydrophobicContact CG2-CB 3.65Å
326	N	88.3	Confident	83.1	Confident	26 Å²	26	62.7 Å²	62.7	14%	0.139	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	96.9	174.2	-170.1	-24.9	0	0	0	109	W314 L315 G328 L466 G468	W314-N326 PolarHBondContact O-OD1 2.94Å; L315-N326 HydrophobicContact CD2-CB 3.89Å; N326-G328 PolarHBondContact OD1-N 3.21Å; N326-L466 PolarHBondContact ND2-O 2.88Å; N326-G468 PolarHBondContact ND2-N 3.47Å
327	H	75.8	Confident	83	Confident	114 Å²	114	66.7 Å²	66.7	53%	0.528	35%	0.345	S	S	.	.			trans	-100	11.9	-179.4	-70.9	-79.5	0	0	0	113.1	W314 T325 P475	W314-H327 PolarHBondContact O-N 3.38Å; T325-H327 WeakPolarHBondContact CB-NE2 3.49Å; T325-H327 PolarHBondContact OG1-CD2 3.48Å; T325-H327 PolarHBondContact OG1-NE2 3.18Å; H327-P475 WeakPolarHBondContact CE1-CG 3.28Å; H327-P475 WeakPolarHBondContact ND1-CG 3.4Å
328	G	65.7	Low	82.8	Confident	32 Å²	32	66.3 Å²	66.3	33%	0.33	34%	0.34	S	S	.	.	S	Bend	trans	78.6	-175.7	-172.9	0	0	0	0	0	113.1	W314 N326 R330	W314-G328 WeakPolarHBondContact CA-O 3.39Å; N326-G328 PolarHBondContact OD1-N 3.21Å; G328-R330 PolarHBondContact O-N 3.45Å
329	Y	61.3	Low	82.5	Confident	164 Å²	164	65.1 Å²	65.1	64%	0.643	33%	0.331	S	S	*	.			trans	-62.8	120.4	-164.5	-171.3	-101.9	0	0	0	113.7	V331	Y329-V331 HydrophobicContact CD1-CG2 4.22Å; Y329-V331 HydrophobicContact CE1-CB 4.49Å; Y329-V331 HydrophobicContact CE1-CG2 3.48Å; Y329-V331 VanDerWaalsContact CE1-CG2 3.48Å
330	R	65.3	Low	82.1	Confident	147 Å²	147	64.5 Å²	64.5	56%	0.555	33%	0.334	S	S	*	.			trans	-110.5	128.8	162.9	-82.6	-177.4	161.2	-170.6	-5.6	108.7	G313 G328 Q332	G313-R330 PolarHBondContact O-N 2.97Å; G328-R330 PolarHBondContact O-N 3.45Å; R330-Q332 HydrophobicContact CB-CG 4.46Å; R330-Q332 PolarHBondContact O-N 2.84Å
331	V	57.8	Low	81.6	Confident	125 Å²	125	63.9 Å²	63.9	76%	0.758	34%	0.335	S	S	*	.			trans	-69.3	102.3	170	-179.6	0	0	0	0	107.5	Y329	Y329-V331 HydrophobicContact CD1-CG2 4.22Å; Y329-V331 HydrophobicContact CE1-CB 4.49Å; Y329-V331 HydrophobicContact CE1-CG2 3.48Å; Y329-V331 VanDerWaalsContact CE1-CG2 3.48Å
332	Q	66.1	Low	81.1	Confident	64 Å²	64	61.8 Å²	61.8	30%	0.299	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-103	166.6	169.7	-68	-173.5	-5.5	0	0	109.4	R330 E334 R338	R330-Q332 HydrophobicContact CB-CG 4.46Å; R330-Q332 PolarHBondContact O-N 2.84Å; Q332-E334 PolarHBondContact O-N 3.03Å; Q332-R338 VanDerWaalsContact OE1-CZ 3.24Å
333	V	83.5	Confident	80.8	Confident	29 Å²	29	62 Å²	62	18%	0.176	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-69.9	127.9	171.4	175.3	0	0	0	0	108.7	A171 I172 H175 N335 R338	A171-V333 HydrophobicContact CB-CG2 4.25Å; I172-V333 HydrophobicContact CB-CG1 4.25Å; I172-V333 HydrophobicContact CG1-CG1 3.38Å; H175-V333 HydrophobicContact CB-CB 4.23Å; H175-V333 HydrophobicContact CB-CG2 3.47Å; H175-V333 VanDerWaalsContact CB-CG2 3.47Å; V333-N335 PolarHBondContact O-N 3.39Å; V333-R338 PolarHBondContact O-NH2 3.36Å; V333-R338 VanDerWaalsContact O-NH2 3.15Å
334	E	81.1	Confident	80.6	Confident	130 Å²	130	61.8 Å²	61.8	61%	0.607	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-65.6	130.3	175	-66.3	-61.4	146.6	0	0	110	Q332	Q332-E334 PolarHBondContact O-N 3.03Å
335	N	86.2	Confident	80.6	Confident	37 Å²	37	61.8 Å²	61.8	20%	0.198	33%	0.326	C	S	.	.			trans	-139.1	150.2	175.1	63.7	-43.9	0	0	0	109.1	N309 V333 E337 R338	N309-N335 PolarHBondContact O-ND2 3.12Å; V333-N335 PolarHBondContact O-N 3.39Å; N335-E337 PolarHBondContact O-N 3.26Å; N335-R338 WeakPolarHBondContact O-CB 3.33Å; N335-R338 PolarHBondContact O-N 2.91Å; N335-R338 VanDerWaalsContact OD1-CB 3.3Å; N335-R338 WeakPolarHBondContact OD1-CB 3.35Å; N335-R338 PolarHBondContact OD1-NE 3.04Å; N335-R338 PolarHBondContact OD1-NH2 3.16Å
336	P	86	Confident	80.8	Confident	115 Å²	115	61.6 Å²	61.6	75%	0.747	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.2	-173.7	-25.2	35.5	0	0	0	115.4	R338	P336-R338 PolarHBondContact O-N 3.3Å
337	E	87.7	Confident	81.2	Confident	109 Å²	109	60.3 Å²	60.3	51%	0.509	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-12.1	-177.6	-64.3	168.7	-133.2	0	0	113.4	T310 N335	T310-E337 WeakPolarHBondContact CA-O 3.37Å; N335-E337 PolarHBondContact O-N 3.26Å
338	R	87.5	Confident	82.2	Confident	16 Å²	16	57.8 Å²	57.8	6%	0.06	31%	0.312	C	S	.	.	S	Bend	trans	-80.3	134.8	-171.9	-176.6	177.6	-54.5	-84.2	9	112.6	A311 Q332 V333 N335 P336 S340	A311-R338 WeakPolarHBondContact O-CG 3.39Å; A311-R338 PolarHBondContact O-NH1 3.25Å; Q332-R338 VanDerWaalsContact OE1-CZ 3.24Å; V333-R338 PolarHBondContact O-NH2 3.36Å; V333-R338 VanDerWaalsContact O-NH2 3.15Å; N335-R338 WeakPolarHBondContact O-CB 3.33Å; N335-R338 PolarHBondContact O-N 2.91Å; N335-R338 VanDerWaalsContact OD1-CB 3.3Å; N335-R338 WeakPolarHBondContact OD1-CB 3.35Å; N335-R338 PolarHBondContact OD1-NE 3.04Å; N335-R338 PolarHBondContact OD1-NH2 3.16Å; P336-R338 PolarHBondContact O-N 3.3Å; R338-S340 PolarHBondContact O-N 3.28Å
339	F	86.8	Confident	83.6	Confident	7 Å²	7	62.9 Å²	62.9	3%	0.031	32%	0.321	C	S	.	.			trans	-68.5	117.2	167	-70.7	-71	0	0	0	111.5	T310 A312 C344 L346 H386	T310-F339 WeakPolarHBondContact O-CD2 3.35Å; T310-F339 PolarHBondContact O-N 3.4Å; T310-F339 VanDerWaalsContact O-N 3.11Å; A312-F339 VanDerWaalsContact CA-O 3.22Å; A312-F339 WeakPolarHBondContact CA-O 3.45Å; A312-F339 HydrophobicContact CB-CB 4.25Å; A312-F339 VanDerWaalsContact CB-O 3.27Å; A312-F339 WeakPolarHBondContact CB-O 3.4Å; F339-C344 WeakPolarHBondContact CD1-SG 3.45Å; F339-C344 HydrophobicContact CD2-CB 4.33Å; F339-C344 WeakPolarHBondContact CD2-O 3.35Å; F339-C344 VanDerWaalsContact CD2-SG 3.56Å; F339-C344 WeakPolarHBondContact CG-SG 3.49Å; F339-L346 HydrophobicContact CE2-CD1 4.43Å; F339-L346 HydrophobicContact CE2-CD2 3.75Å; F339-L346 HydrophobicContact CE2-CG 3.8Å; F339-L346 HydrophobicContact CZ-CD2 3.93Å; F339-L346 HydrophobicContact CZ-CG 4.26Å; F339-H386 HydrophobicContact CD1-CB 4.2Å; F339-H386 AromaticContact CD1-CD2 3.71Å; F339-H386 AromaticContact CD1-CG 3.71Å; F339-H386 AromaticContact CD1-ND1 3.95Å; F339-H386 AromaticContact CD1-NE2 3.96Å; F339-H386 HydrophobicContact CE1-CB 4.46Å; F339-H386 AromaticContact CE1-CE1 3.75Å; F339-H386 AromaticContact CE1-CG 3.84Å; F339-H386 AromaticContact CE1-ND1 3.6Å
340	S	82.4	Confident	85.3	Confident	73 Å²	73	58.6 Å²	58.6	51%	0.51	31%	0.312	S	S	.	.	S	Bend	trans	-98.1	-21.6	179.9	55.6	0	0	0	0	114	R338	R338-S340 PolarHBondContact O-N 3.28Å
341	S	81.1	Confident	86.8	Confident	58 Å²	58	52.1 Å²	52.1	41%	0.406	29%	0.288	S	S	.	.	S	Bend	trans	-101.6	-19.3	-170	56.5	0	0	0	0	115.1	H386	S341-H386 PolarHBondContact OG-O 2.92Å
342	A	84	Confident	88.5	Confident	14 Å²	14	49.1 Å²	49.1	12%	0.116	27%	0.273	C	S	.	.	S	Bend	trans	-149.2	148.9	-174.4	0	0	0	0	0	112.5	A312 C344 Y465	A312-A342 WeakPolarHBondContact CB-O 3.22Å; A342-C344 PolarHBondContact O-N 3.5Å; A342-C344 PolarHBondContact O-SG 3Å; A342-C344 VanDerWaalsContact O-SG 3.39Å; A342-Y465 HydrophobicContact CB-CD2 4.48Å; A342-Y465 HydrophobicContact CB-CE2 4.23Å
343	P	88.8	Confident	89.9	Confident	15 Å²	15	52.9 Å²	52.9	10%	0.097	29%	0.29	C	S	.	.	S	Bend	trans	-69.2	73.6	175	29.3	-36.2	0	0	0	112.2	L315 Y465 L466	L315-P343 HydrophobicContact CD2-CB 4.08Å; L315-P343 HydrophobicContact CG-CB 4.48Å; P343-Y465 VanDerWaalsContact CD-CE2 3.46Å; P343-Y465 HydrophobicContact CG-CD2 3.93Å; P343-Y465 HydrophobicContact CG-CE1 4.13Å; P343-Y465 HydrophobicContact CG-CE2 3.36Å; P343-Y465 VanDerWaalsContact CG-CZ 3.44Å; P343-Y465 CarbonylContact O-C 3.53Å; P343-Y465 VanDerWaalsContact O-CA 3.23Å; P343-Y465 WeakPolarHBondContact O-CA 3.16Å; P343-Y465 WeakPolarHBondContact O-CD2 3.44Å; P343-L466 WeakPolarHBondContact CB-O 3.37Å; P343-L466 WeakPolarHBondContact CG-O 3.42Å; P343-L466 PolarHBondContact O-N 3.41Å
344	C	91.3	Very high	90.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	163.9	177.7	54.2	0	0	0	0	111.9	A312 F339 A342 Y463 F464 Y465	A312-C344 PolarHBondContact N-O 3.26Å; F339-C344 WeakPolarHBondContact CD1-SG 3.45Å; F339-C344 HydrophobicContact CD2-CB 4.33Å; F339-C344 WeakPolarHBondContact CD2-O 3.35Å; F339-C344 VanDerWaalsContact CD2-SG 3.56Å; F339-C344 WeakPolarHBondContact CG-SG 3.49Å; A342-C344 PolarHBondContact O-N 3.5Å; A342-C344 PolarHBondContact O-SG 3Å; A342-C344 VanDerWaalsContact O-SG 3.39Å; C344-Y463 HydrophobicContact CB-CE2 3.64Å; C344-F464 WeakPolarHBondContact CA-O 3.44Å; C344-F464 WeakPolarHBondContact CB-O 3.43Å; C344-Y465 HydrophobicContact CB-CD2 4.39Å
345	L	94.1	Very high	91.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	164.6	-179.6	76.8	171.1	0	0	0	109.3	F306 A311 L315 V317 V324 F464 L466	F306-L345 HydrophobicContact CB-CD1 3.81Å; F306-L345 HydrophobicContact CD1-CD1 3.68Å; F306-L345 HydrophobicContact CD1-CG 4.02Å; F306-L345 HydrophobicContact CE1-CD1 4.48Å; F306-L345 HydrophobicContact CG-CD1 3.82Å; A311-L345 HydrophobicContact CB-CB 3.79Å; A311-L345 HydrophobicContact CB-CD1 4.2Å; L315-L345 HydrophobicContact CD1-CB 4.27Å; L315-L345 HydrophobicContact CD1-CD2 3.91Å; V317-L345 HydrophobicContact CG2-CD1 3.91Å; V324-L345 HydrophobicContact CB-CD1 4.09Å; V324-L345 HydrophobicContact CG1-CD1 4.33Å; V324-L345 HydrophobicContact CG1-CD2 4.18Å; V324-L345 HydrophobicContact CG2-CD1 3.87Å; V324-L345 HydrophobicContact CG2-CD2 4.26Å; L345-F464 HydrophobicContact CD2-CB 3.59Å; L345-F464 HydrophobicContact CG-CB 4.45Å; L345-F464 PolarHBondContact N-O 2.88Å; L345-F464 PolarHBondContact O-N 2.81Å; L345-F464 VanDerWaalsContact O-N 3.09Å; L345-L466 HydrophobicContact CD2-CD1 4.07Å
346	L	96.6	Very high	91.6	Very high	18 Å²	18	51.5 Å²	51.5	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	157.7	178.6	-53.1	-174.7	0	0	0	112.1	D307 T310 F339 V373 R461 P462 Y463	D307-L346 WeakPolarHBondContact CB-O 3.44Å; D307-L346 PolarHBondContact N-O 3.4Å; T310-L346 HydrophobicContact CG2-CB 4.09Å; T310-L346 HydrophobicContact CG2-CD1 4.07Å; T310-L346 HydrophobicContact CG2-CG 4.1Å; T310-L346 PolarHBondContact OG1-N 2.83Å; F339-L346 HydrophobicContact CE2-CD1 4.43Å; F339-L346 HydrophobicContact CE2-CD2 3.75Å; F339-L346 HydrophobicContact CE2-CG 3.8Å; F339-L346 HydrophobicContact CZ-CD2 3.93Å; F339-L346 HydrophobicContact CZ-CG 4.26Å; L346-V373 HydrophobicContact CD1-CG1 4.36Å; L346-V373 HydrophobicContact CD2-CG1 3.52Å; L346-R461 HydrophobicContact CB-CB 4.46Å; L346-R461 HydrophobicContact CD1-CB 4.39Å; L346-P462 CarbonylContact C-O 3.54Å; L346-P462 VanDerWaalsContact CA-O 3.27Å; L346-P462 WeakPolarHBondContact CA-O 3.15Å; L346-Y463 HydrophobicContact CD2-CD2 3.99Å
347	G	97.1	Very high	92.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-74	155	162.8	0	0	0	0	0	111.6	S305 R349 R461 P462	S305-G347 CarbonylContact O-C 3.58Å; S305-G347 VanDerWaalsContact O-CA 3.31Å; S305-G347 WeakPolarHBondContact O-CA 3.22Å; G347-R349 VanDerWaalsContact C-N 3.28Å; G347-R349 PolarHBondContact O-N 3.02Å; G347-R461 VanDerWaalsContact O-CZ 3.24Å; G347-R461 PolarHBondContact O-NE 3.19Å; G347-R461 PolarHBondContact O-NH2 3.3Å; G347-P462 PolarHBondContact N-O 2.76Å
348	S	95.8	Very high	92.6	Very high	60 Å²	60	43.3 Å²	43.3	42%	0.42	26%	0.256	S	S	.	.	S	Bend	trans	-72.9	-14.3	-174.5	61.8	0	0	0	0	114.7	S305	S305-S348 PolarHBondContact N-OG 3.28Å; S305-S348 VanDerWaalsContact N-OG 3.12Å; S305-S348 WeakPolarHBondContact O-CB 3.44Å; S305-S348 PolarHBondContact O-N 3.47Å; S305-S348 PolarHBondContact O-OG 3.36Å
349	R	95.8	Very high	93.1	Very high	139 Å²	139	45 Å²	45	53%	0.525	27%	0.265	S	S	.	.			trans	-104	145.9	-178.1	-69	-168	178.1	-174.5	0.1	112.5	P303 F304 G347 F351 R461 P462	P303-R349 WeakPolarHBondContact O-CD 3.43Å; P303-R349 PolarHBondContact O-NE 2.9Å; P303-R349 PolarHBondContact O-NH1 2.86Å; F304-R349 HydrophobicContact CB-CB 4.07Å; F304-R349 HydrophobicContact CB-CG 3.79Å; G347-R349 VanDerWaalsContact C-N 3.28Å; G347-R349 PolarHBondContact O-N 3.02Å; R349-F351 HydrophobicContact CB-CE1 4.29Å; R349-F351 HydrophobicContact CB-CZ 4.27Å; R349-R461 WeakPolarHBondContact O-CG 3.25Å; R349-P462 WeakPolarHBondContact O-CD 3.46Å
350	V	96.6	Very high	93.6	Very high	74 Å²	74	44.7 Å²	44.7	45%	0.448	26%	0.264	S	S	.	.			trans	-100.9	130.7	166.7	-179	0	0	0	0	107.9	V375 E459 V460 R461	V350-V375 HydrophobicContact CG1-CG2 4.06Å; V350-V375 HydrophobicContact CG2-CG2 4.25Å; V350-E459 HydrophobicContact CG1-CB 3.93Å; V350-V460 CarbonylContact C-O 3.57Å; V350-V460 WeakPolarHBondContact CA-O 3.31Å; V350-R461 HydrophobicContact CB-CG 4.47Å; V350-R461 HydrophobicContact CG2-CG 3.77Å
351	F	96.4	Very high	94.3	Very high	11 Å²	11	42.8 Å²	42.8	5%	0.048	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-107.3	132.3	173.9	-58.9	-58.6	0	0	0	109.4	F304 R349 H356 W358 L432 E459 V460 P462	F304-F351 HydrophobicContact CD1-CE2 4.32Å; F304-F351 AromaticContact CD1-CZ 3.96Å; F304-F351 HydrophobicContact CD1-CZ 3.96Å; F304-F351 HydrophobicContact CE1-CE2 4.43Å; F304-F351 HydrophobicContact CE1-CZ 4.41Å; R349-F351 HydrophobicContact CB-CE1 4.29Å; R349-F351 HydrophobicContact CB-CZ 4.27Å; F351-H356 HydrophobicContact CD1-CB 4.38Å; F351-H356 AromaticContact CD1-CD2 3.71Å; F351-H356 AromaticContact CD1-CE1 3.56Å; F351-H356 AromaticContact CD1-CG 3.56Å; F351-H356 AromaticContact CD1-ND1 3.45Å; F351-H356 WeakPolarHBondContact CD1-ND1 3.47Å; F351-H356 AromaticContact CD1-NE2 3.7Å; F351-H356 HydrophobicContact CE1-CB 4.22Å; F351-H356 AromaticContact CE1-CE1 3.88Å; F351-H356 AromaticContact CE1-CG 3.68Å; F351-H356 AromaticContact CE1-ND1 3.36Å; F351-H356 WeakPolarHBondContact CE1-ND1 3.46Å; F351-H356 HydrophobicContact CZ-CB 4.37Å; F351-W358 HydrophobicContact CD2-CZ3 4.48Å; F351-W358 HydrophobicContact CE2-CE3 4.45Å; F351-W358 HydrophobicContact CE2-CH2 4.34Å; F351-W358 AromaticContact CE2-CZ3 3.96Å; F351-W358 HydrophobicContact CE2-CZ3 3.96Å; F351-L432 HydrophobicContact CB-CD2 3.73Å; F351-L432 HydrophobicContact CD2-CD2 3.97Å; F351-L432 HydrophobicContact CG-CD2 4.12Å; F351-E459 WeakPolarHBondContact O-CA 3.41Å; F351-V460 HydrophobicContact CB-CG2 4.11Å; F351-V460 PolarHBondContact N-O 3.34Å; F351-V460 PolarHBondContact O-N 3.01Å; F351-P462 HydrophobicContact CD2-CG 4.24Å; F351-P462 HydrophobicContact CE2-CG 3.57Å; F351-P462 HydrophobicContact CZ-CG 4.48Å
352	S	94.5	Very high	94.9	Very high	62 Å²	62	40 Å²	40	43%	0.434	23%	0.233	S	C	.	.			trans	-136.4	-21.7	-179.4	59.4	0	0	0	0	113.7
353	Q	94.4	Very high	95	Very high	144 Å²	144	40.8 Å²	40.8	67%	0.673	24%	0.242	S	C	*	.	S	Bend	trans	-150.5	154.2	-176.2	-63.8	-179.2	-1.9	0	0	110	H356	Q353-H356 PolarHBondContact O-NE2 2.58Å
354	G	95	Very high	94.8	Very high	25 Å²	25	41.4 Å²	41.4	26%	0.258	25%	0.251	S	S	.	.	S	Bend	trans	77.7	176.2	178.8	0	0	0	0	0	115	H356 C434 E435	G354-H356 PolarHBondContact O-CD2 2.98Å; G354-H356 VanDerWaalsContact O-CD2 3.24Å; G354-H356 PolarHBondContact O-NE2 3.4Å; G354-C434 PolarHBondContact O-N 3.44Å; G354-C434 PolarHBondContact O-SG 2.78Å; G354-E435 VanDerWaalsContact CA-OE2 3.28Å; G354-E435 WeakPolarHBondContact CA-OE2 3.4Å; G354-E435 PolarHBondContact N-OE1 2.97Å; G354-E435 PolarHBondContact N-OE2 3.31Å
355	S	95.9	Very high	94.6	Very high	87 Å²	87	42.3 Å²	42.3	61%	0.608	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	130.4	175.6	-28	0	0	0	0	111.4	L432 E433	S355-L432 CarbonylContact C-O 3.57Å; S355-L432 WeakPolarHBondContact CA-O 3.48Å; S355-E433 VanDerWaalsContact CB-OE2 3.27Å; S355-E433 WeakPolarHBondContact CB-OE2 3.39Å; S355-E433 PolarHBondContact OG-OE2 2.7Å
356	H	96.7	Very high	94.2	Very high	54 Å²	54	47 Å²	47	25%	0.25	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.4	179.1	-56.5	-82.8	0	0	0	110.2	F351 Q353 G354 W358 E431 L432	F351-H356 HydrophobicContact CD1-CB 4.38Å; F351-H356 AromaticContact CD1-CD2 3.71Å; F351-H356 AromaticContact CD1-CE1 3.56Å; F351-H356 AromaticContact CD1-CG 3.56Å; F351-H356 AromaticContact CD1-ND1 3.45Å; F351-H356 WeakPolarHBondContact CD1-ND1 3.47Å; F351-H356 AromaticContact CD1-NE2 3.7Å; F351-H356 HydrophobicContact CE1-CB 4.22Å; F351-H356 AromaticContact CE1-CE1 3.88Å; F351-H356 AromaticContact CE1-CG 3.68Å; F351-H356 AromaticContact CE1-ND1 3.36Å; F351-H356 WeakPolarHBondContact CE1-ND1 3.46Å; F351-H356 HydrophobicContact CZ-CB 4.37Å; Q353-H356 PolarHBondContact O-NE2 2.58Å; G354-H356 PolarHBondContact O-CD2 2.98Å; G354-H356 VanDerWaalsContact O-CD2 3.24Å; G354-H356 PolarHBondContact O-NE2 3.4Å; H356-W358 HydrophobicContact CB-CZ3 4.25Å; H356-E431 CarbonylContact O-C 3.55Å; H356-E431 WeakPolarHBondContact O-CA 3.33Å; H356-L432 HydrophobicContact CB-CB 4.49Å; H356-L432 PolarHBondContact N-O 2.85Å; H356-L432 PolarHBondContact O-N 3.49Å
357	A	96.6	Very high	93.8	Very high	46 Å²	46	48.2 Å²	48.2	38%	0.38	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.8	175.4	0	0	0	0	0	111.1	V430 E431	A357-V430 VanDerWaalsContact CA-O 3.26Å; A357-V430 WeakPolarHBondContact CA-O 3.41Å; A357-E431 HydrophobicContact CB-CG 4.15Å
358	W	97.8	Very high	93.5	Very high	6 Å²	6	48.3 Å²	48.3	2%	0.023	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	154	172.9	64.4	95.6	0	0	0	111.3	P303 F304 F351 H356 V372 R429 V430 L432 P462	P303-W358 HydrophobicContact CB-CB 4.29Å; P303-W358 HydrophobicContact CG-CB 3.49Å; P303-W358 VanDerWaalsContact CG-CB 3.49Å; F304-W358 HydrophobicContact CE1-CB 3.95Å; F304-W358 AromaticContact CE1-CD1 3.94Å; F304-W358 AromaticContact CE1-CD2 3.62Å; F304-W358 HydrophobicContact CE1-CD2 3.62Å; F304-W358 HydrophobicContact CE1-CE3 4.06Å; F304-W358 AromaticContact CE1-CG 3.57Å; F304-W358 HydrophobicContact CE1-CG 3.57Å; F304-W358 HydrophobicContact CZ-CB 4.43Å; F304-W358 AromaticContact CZ-CD1 3.67Å; F304-W358 HydrophobicContact CZ-CD2 4.01Å; F304-W358 AromaticContact CZ-CE2 3.98Å; F304-W358 AromaticContact CZ-CG 3.8Å; F304-W358 HydrophobicContact CZ-CG 3.8Å; F304-W358 AromaticContact CZ-NE1 3.77Å; F351-W358 HydrophobicContact CD2-CZ3 4.48Å; F351-W358 HydrophobicContact CE2-CE3 4.45Å; F351-W358 HydrophobicContact CE2-CH2 4.34Å; F351-W358 AromaticContact CE2-CZ3 3.96Å; F351-W358 HydrophobicContact CE2-CZ3 3.96Å; H356-W358 HydrophobicContact CB-CZ3 4.25Å; W358-V372 HydrophobicContact CH2-CG1 3.69Å; W358-V372 HydrophobicContact CZ2-CG1 3.98Å; W358-R429 WeakPolarHBondContact O-CA 3.43Å; W358-V430 HydrophobicContact CD2-CB 3.98Å; W358-V430 HydrophobicContact CD2-CG1 4.45Å; W358-V430 HydrophobicContact CE3-CB 4.49Å; W358-V430 HydrophobicContact CG-CB 4.45Å; W358-V430 HydrophobicContact CH2-CB 4.25Å; W358-V430 HydrophobicContact CH2-CG1 3.67Å; W358-V430 HydrophobicContact CZ2-CB 3.73Å; W358-V430 HydrophobicContact CZ2-CG1 3.4Å; W358-V430 VanDerWaalsContact CZ2-CG1 3.4Å; W358-V430 HydrophobicContact CZ2-CG2 4.25Å; W358-V430 HydrophobicContact CZ3-CG1 4.3Å; W358-V430 PolarHBondContact N-O 2.97Å; W358-V430 PolarHBondContact O-N 2.96Å; W358-L432 HydrophobicContact CH2-CB 4.31Å; W358-L432 HydrophobicContact CZ3-CB 4.11Å; W358-P462 HydrophobicContact CZ2-CB 4.4Å; W358-P462 HydrophobicContact CZ2-CG 4.42Å
359	E	97.7	Very high	93.4	Very high	53 Å²	53	48.4 Å²	48.4	25%	0.248	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145	175.1	-72.6	-176.1	-168	0	0	110.6	R427 L428 R429 A444 C481	E359-R427 WeakPolarHBondContact OE2-CD 3.45Å; E359-L428 CarbonylContact C-O 3.54Å; E359-L428 WeakPolarHBondContact CA-O 3.48Å; E359-R429 HydrophobicContact CG-CB 3.89Å; E359-R429 HydrophobicContact CG-CG 4.12Å; E359-A444 HydrophobicContact CG-CB 4.43Å; E359-C481 HydrophobicContact CB-CB 3.72Å; E359-C481 PolarHBondContact O-N 3.06Å
360	V	97.4	Very high	93.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	118.9	-179.5	-174.2	0	0	0	0	108.6	L362 V370 R427 L428 F464 L478 R479	V360-L362 HydrophobicContact CG1-CD2 4.01Å; V360-L362 PolarHBondContact O-N 2.92Å; V360-V370 HydrophobicContact CG1-CG2 4.28Å; V360-V370 HydrophobicContact CG2-CG1 3.96Å; V360-R427 VanDerWaalsContact O-CA 3.32Å; V360-R427 WeakPolarHBondContact O-CA 3.43Å; V360-L428 PolarHBondContact N-O 3.33Å; V360-L428 PolarHBondContact O-N 3.3Å; V360-F464 HydrophobicContact CG2-CE1 3.92Å; V360-L478 HydrophobicContact CG1-CD1 4.12Å; V360-L478 HydrophobicContact CG1-CD2 3.43Å; V360-L478 VanDerWaalsContact CG1-CD2 3.43Å; V360-L478 HydrophobicContact CG1-CG 3.62Å; V360-R479 CarbonylContact C-O 3.58Å; V360-R479 WeakPolarHBondContact CA-O 3.41Å
361	A	96.6	Very high	93.5	Very high	32 Å²	32	38.2 Å²	38.2	26%	0.264	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	115.7	169.6	0	0	0	0	0	109.3	R479	A361-R479 HydrophobicContact CB-CB 4.31Å; A361-R479 PolarHBondContact N-O 3Å; A361-R479 PolarHBondContact O-N 2.85Å; A361-R479 VanDerWaalsContact O-N 3.08Å
362	L	93	Very high	93.5	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	23%	0.23	C	C	.	.			trans	-99.5	-20.6	-179.9	-60.4	170.1	0	0	0	112	V360 G364 L365 W368 V370 P425 R426 L428 L478	V360-L362 HydrophobicContact CG1-CD2 4.01Å; V360-L362 PolarHBondContact O-N 2.92Å; L362-G364 PolarHBondContact O-N 2.81Å; L362-L365 VanDerWaalsContact O-CB 3.22Å; L362-L365 WeakPolarHBondContact O-CB 3.35Å; L362-L365 WeakPolarHBondContact O-CD1 3.44Å; L362-L365 WeakPolarHBondContact O-CG 3.46Å; L362-L365 PolarHBondContact O-N 2.9Å; L362-L365 VanDerWaalsContact O-N 3.09Å; L362-W368 HydrophobicContact CD1-CD2 3.96Å; L362-W368 HydrophobicContact CD1-CE3 4.14Å; L362-W368 HydrophobicContact CD1-CH2 3.72Å; L362-W368 HydrophobicContact CD1-CZ2 3.49Å; L362-W368 VanDerWaalsContact CD1-CZ2 3.49Å; L362-W368 HydrophobicContact CD1-CZ3 4.03Å; L362-W368 HydrophobicContact CD2-CB 4.39Å; L362-W368 HydrophobicContact CD2-CD2 3.84Å; L362-W368 HydrophobicContact CD2-CE3 4.08Å; L362-W368 HydrophobicContact CD2-CG 3.97Å; L362-W368 HydrophobicContact CG-CD2 4.45Å; L362-V370 HydrophobicContact CD2-CG2 3.89Å; L362-P425 HydrophobicContact CD1-CG 4.38Å; L362-R426 WeakPolarHBondContact CA-O 3.43Å; L362-R426 WeakPolarHBondContact CB-O 3.26Å; L362-R426 PolarHBondContact N-O 2.95Å; L362-L428 HydrophobicContact CD1-CB 3.76Å; L362-L428 HydrophobicContact CG-CB 4.46Å; L362-L478 HydrophobicContact CD2-CD1 3.83Å; L362-L478 HydrophobicContact CD2-CG 4.29Å
363	G	86.4	Confident	93.5	Very high	30 Å²	30	35.3 Å²	35.3	31%	0.309	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	-126.5	177.2	0	0	0	0	0	112.3	R426	G363-R426 PolarHBondContact N-O 3.44Å; G363-R426 VanDerWaalsContact N-O 3.12Å
364	G	84.7	Confident	93.5	Very high	27 Å²	27	33.5 Å²	33.5	28%	0.278	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	17.4	174.6	0	0	0	0	0	113.4	L362 Q366 E476	L362-G364 PolarHBondContact O-N 2.81Å; G364-Q366 PolarHBondContact O-N 3.34Å; G364-Q366 PolarHBondContact O-NE2 3.23Å; G364-E476 WeakPolarHBondContact CA-OE2 3.39Å; G364-E476 PolarHBondContact N-OE2 3.39Å
365	L	87.7	Confident	93.2	Very high	20 Å²	20	34.7 Å²	34.7	11%	0.105	20%	0.202	C	C	.	.			trans	-56.8	125.6	-176.9	-74.7	173.3	0	0	0	112.3	L362 W368 R401 E476 L478	L362-L365 VanDerWaalsContact O-CB 3.22Å; L362-L365 WeakPolarHBondContact O-CB 3.35Å; L362-L365 WeakPolarHBondContact O-CD1 3.44Å; L362-L365 WeakPolarHBondContact O-CG 3.46Å; L362-L365 PolarHBondContact O-N 2.9Å; L362-L365 VanDerWaalsContact O-N 3.09Å; L365-W368 VanDerWaalsContact O-CD1 3.28Å; L365-W368 PolarHBondContact O-NE1 3.02Å; L365-R401 WeakPolarHBondContact O-CD 3.38Å; L365-R401 PolarHBondContact O-NH1 3.47Å; L365-E476 HydrophobicContact CD2-CB 4.13Å; L365-E476 WeakPolarHBondContact CD2-O 3.26Å; L365-L478 HydrophobicContact CD1-CB 3.77Å; L365-L478 HydrophobicContact CD1-CD1 4.42Å; L365-L478 HydrophobicContact CD1-CG 4.44Å
366	Q	84.9	Confident	92.2	Very high	98 Å²	98	38.8 Å²	38.8	46%	0.458	20%	0.204	S	C	.	.	S	Bend	trans	-83.6	-18.7	-174	-57.2	-63.9	-48.2	0	0	113.7	G364 R401	G364-Q366 PolarHBondContact O-N 3.34Å; G364-Q366 PolarHBondContact O-NE2 3.23Å; Q366-R401 WeakPolarHBondContact O-CD 3.48Å
367	S	88	Confident	90.3	Very high	43 Å²	43	44.5 Å²	44.5	30%	0.301	23%	0.231	S	C	.	.	S	Bend	trans	-149.7	116.8	177.1	-178.8	0	0	0	0	110.1	G467	S367-G467 PolarHBondContact O-N 2.75Å
368	W	91.9	Very high	88	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.008	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	155.1	-178.6	52.9	-99.7	0	0	0	110.3	L362 L365 V370 V399 C400 R401 I424 P425 L428 Y465	L362-W368 HydrophobicContact CD1-CD2 3.96Å; L362-W368 HydrophobicContact CD1-CE3 4.14Å; L362-W368 HydrophobicContact CD1-CH2 3.72Å; L362-W368 HydrophobicContact CD1-CZ2 3.49Å; L362-W368 VanDerWaalsContact CD1-CZ2 3.49Å; L362-W368 HydrophobicContact CD1-CZ3 4.03Å; L362-W368 HydrophobicContact CD2-CB 4.39Å; L362-W368 HydrophobicContact CD2-CD2 3.84Å; L362-W368 HydrophobicContact CD2-CE3 4.08Å; L362-W368 HydrophobicContact CD2-CG 3.97Å; L362-W368 HydrophobicContact CG-CD2 4.45Å; L365-W368 VanDerWaalsContact O-CD1 3.28Å; L365-W368 PolarHBondContact O-NE1 3.02Å; W368-V370 HydrophobicContact CE3-CG2 4.06Å; W368-V370 HydrophobicContact CZ3-CG2 4.49Å; W368-V399 HydrophobicContact CH2-CG1 4.29Å; W368-V399 HydrophobicContact CZ3-CG1 4.34Å; W368-V399 WeakPolarHBondContact CZ3-O 3.29Å; W368-C400 VanDerWaalsContact O-CA 3.24Å; W368-C400 WeakPolarHBondContact O-CA 3.11Å; W368-C400 WeakPolarHBondContact O-CB 3.29Å; W368-R401 HydrophobicContact CD2-CB 4.09Å; W368-R401 VanDerWaalsContact CE2-CB 3.49Å; W368-R401 HydrophobicContact CG-CB 4.36Å; W368-R401 HydrophobicContact CZ2-CB 3.81Å; W368-R401 PolarHBondContact O-N 3.09Å; W368-R401 VanDerWaalsContact O-N 3.17Å; W368-I424 HydrophobicContact CZ2-CG2 4.33Å; W368-P425 HydrophobicContact CH2-CG 4.2Å; W368-P425 HydrophobicContact CZ2-CG 4.23Å; W368-L428 HydrophobicContact CH2-CD2 4.47Å; W368-L428 HydrophobicContact CZ3-CD2 4.08Å; W368-Y465 CarbonylContact C-O 3.53Å; W368-Y465 WeakPolarHBondContact CA-O 3.34Å
369	R	93.6	Very high	85.1	Confident	62 Å²	62	53.1 Å²	53.1	23%	0.234	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	138.2	166.1	-41.1	175.3	172.1	173.6	-2.5	108.2	Y398 V399 C400 Y463 F464 Y465	R369-Y398 HydrophobicContact CB-CD2 3.89Å; R369-Y398 HydrophobicContact CB-CE2 4.26Å; R369-Y398 HydrophobicContact CB-CG 4.17Å; R369-Y398 HydrophobicContact CG-CD2 4.29Å; R369-Y398 HydrophobicContact CG-CE2 4.15Å; R369-V399 WeakPolarHBondContact CA-O 3.37Å; R369-C400 HydrophobicContact CB-CB 3.89Å; R369-C400 HydrophobicContact CG-CB 3.52Å; R369-Y463 HydrophobicContact CB-CE1 4.17Å; R369-F464 CarbonylContact O-C 3.59Å; R369-F464 WeakPolarHBondContact O-CA 3.47Å; R369-Y465 HydrophobicContact CB-CG 4.42Å; R369-Y465 HydrophobicContact CG-CD1 3.81Å; R369-Y465 HydrophobicContact CG-CG 3.79Å; R369-Y465 PolarHBondContact N-O 3.3Å; R369-Y465 PolarHBondContact O-N 3.25Å
370	V	97	Very high	82.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132	176.8	177.9	0	0	0	0	108.7	V360 L362 W368 Y398 V399 L428 V430 F441 F464 L478	V360-V370 HydrophobicContact CG1-CG2 4.28Å; V360-V370 HydrophobicContact CG2-CG1 3.96Å; L362-V370 HydrophobicContact CD2-CG2 3.89Å; W368-V370 HydrophobicContact CE3-CG2 4.06Å; W368-V370 HydrophobicContact CZ3-CG2 4.49Å; V370-Y398 VanDerWaalsContact O-CA 3.31Å; V370-Y398 WeakPolarHBondContact O-CA 3.41Å; V370-Y398 VanDerWaalsContact O-CB 3.26Å; V370-Y398 WeakPolarHBondContact O-CB 3.48Å; V370-V399 PolarHBondContact N-O 2.94Å; V370-V399 PolarHBondContact O-N 3.5Å; V370-L428 HydrophobicContact CB-CD2 3.68Å; V370-L428 HydrophobicContact CG1-CD2 3.88Å; V370-L428 HydrophobicContact CG2-CD2 4.28Å; V370-V430 HydrophobicContact CG1-CG2 3.86Å; V370-F441 VanDerWaalsContact O-CE1 3.3Å; V370-F441 WeakPolarHBondContact O-CE1 3.49Å; V370-F464 HydrophobicContact CG1-CD1 4.3Å; V370-F464 HydrophobicContact CG1-CE1 4.06Å; V370-F464 HydrophobicContact CG2-CD1 4.19Å; V370-L478 HydrophobicContact CG2-CD1 4.12Å
371	G	97.1	Very high	79.4	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.5	-142.5	177.4	0	0	0	0	0	112.3	W397 Y463	G371-W397 CarbonylContact C-O 3.56Å; G371-W397 WeakPolarHBondContact CA-O 3.33Å; G371-Y463 PolarHBondContact N-O 3.18Å; G371-Y463 PolarHBondContact O-N 2.65Å
372	V	96.8	Very high	76.5	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	154.4	178.1	-55.6	0	0	0	0	111.2	W358 W397 L439 V460 R461	W358-V372 HydrophobicContact CH2-CG1 3.69Å; W358-V372 HydrophobicContact CZ2-CG1 3.98Å; V372-W397 HydrophobicContact CG2-CB 4.2Å; V372-W397 HydrophobicContact CG2-CE3 4.05Å; V372-W397 PolarHBondContact N-O 3.37Å; V372-W397 PolarHBondContact O-N 2.82Å; V372-L439 HydrophobicContact CG1-CD1 4.14Å; V372-L439 HydrophobicContact CG2-CD1 4.43Å; V372-L439 HydrophobicContact CG2-CD2 3.68Å; V372-V460 HydrophobicContact CB-CB 4.1Å; V372-V460 HydrophobicContact CB-CG2 4.23Å; V372-V460 HydrophobicContact CG1-CG2 4.49Å; V372-V460 HydrophobicContact CG2-CB 4.28Å; V372-V460 HydrophobicContact CG2-CG1 4.26Å; V372-V460 HydrophobicContact CG2-CG2 4.38Å; V372-R461 CarbonylContact C-O 3.46Å; V372-R461 VanDerWaalsContact CA-O 3.28Å; V372-R461 WeakPolarHBondContact CA-O 3.32Å
373	V	94.7	Very high	73.7	Confident	12 Å²	12	69.3 Å²	69.3	7%	0.073	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.4	174	63.4	0	0	0	0	110	L346 V375 G395 F396 V460 R461	L346-V373 HydrophobicContact CD1-CG1 4.36Å; L346-V373 HydrophobicContact CD2-CG1 3.52Å; V373-V375 PolarHBondContact O-N 3.47Å; V373-G395 CarbonylContact C-O 3.54Å; V373-G395 WeakPolarHBondContact CA-O 3.37Å; V373-F396 HydrophobicContact CB-CD1 3.9Å; V373-F396 HydrophobicContact CB-CE1 3.89Å; V373-F396 HydrophobicContact CB-CG 4.47Å; V373-F396 HydrophobicContact CB-CZ 4.44Å; V373-F396 HydrophobicContact CG2-CD1 3.62Å; V373-F396 HydrophobicContact CG2-CD2 4.05Å; V373-F396 HydrophobicContact CG2-CE1 3.34Å; V373-F396 HydrophobicContact CG2-CE2 3.79Å; V373-F396 HydrophobicContact CG2-CG 3.97Å; V373-F396 HydrophobicContact CG2-CZ 3.41Å; V373-F396 VanDerWaalsContact CG2-CZ 3.41Å; V373-V460 CarbonylContact O-C 3.56Å; V373-V460 WeakPolarHBondContact O-CA 3.25Å; V373-V460 WeakPolarHBondContact O-CB 3.34Å; V373-R461 HydrophobicContact CG1-CB 4.39Å; V373-R461 PolarHBondContact N-O 2.95Å; V373-R461 PolarHBondContact O-N 2.88Å
374	R	93.4	Very high	71.6	Confident	105 Å²	105	72.6 Å²	72.6	40%	0.396	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	131.2	171.4	-175.1	174.8	-62.5	-158.5	6.6	111.3	R376 G395 W397 R456 F457 E459	R374-R376 PolarHBondContact O-N 3.46Å; R374-G395 PolarHBondContact N-O 3.4Å; R374-W397 HydrophobicContact CB-CH2 4.25Å; R374-W397 HydrophobicContact CB-CZ3 3.96Å; R374-R456 PolarHBondContact NH2-O 3.17Å; R374-F457 VanDerWaalsContact CZ-O 3.23Å; R374-F457 PolarHBondContact NE-O 3.19Å; R374-F457 PolarHBondContact NH2-O 3.49Å; R374-E459 WeakPolarHBondContact CA-O 3.32Å
375	V	89.2	Confident	69.6	Low	51 Å²	51	76 Å²	76	31%	0.309	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-68.3	119.9	168.1	-176.7	0	0	0	0	108.1	V350 V373 E459 R461	V350-V375 HydrophobicContact CG1-CG2 4.06Å; V350-V375 HydrophobicContact CG2-CG2 4.25Å; V373-V375 PolarHBondContact O-N 3.47Å; V375-E459 HydrophobicContact CB-CB 4.22Å; V375-E459 HydrophobicContact CG2-CB 4.33Å; V375-E459 PolarHBondContact N-O 2.77Å; V375-R461 HydrophobicContact CG2-CG 3.77Å
376	R	74.8	Confident	67.8	Low	172 Å²	172	77.5 Å²	77.5	65%	0.649	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-83.7	121.2	174.1	-66.1	-173.5	175.4	-170.5	-2.1	108.5	R374 D378 S394	R374-R376 PolarHBondContact O-N 3.46Å; R376-D378 PolarHBondContact O-N 3.32Å; R376-S394 PolarHBondContact NH2-O 3.3Å
377	Q	56.8	Low	65.9	Low	175 Å²	175	75.9 Å²	75.9	82%	0.818	44%	0.436	S	S	*	.			trans	-75.5	109.4	163	-93.3	176	-11.5	0	0	107.5	S379	Q377-S379 PolarHBondContact O-N 2.9Å
378	D	48.4	Very low	64.1	Low	114 Å²	114	78.4 Å²	78.4	61%	0.61	45%	0.453	S	S	*	.			trans	-66.6	103.1	177.4	-83.1	-16.7	0	0	0	110.7	R376 H384	R376-D378 PolarHBondContact O-N 3.32Å; D378-H384 IonicContact OD1-NE2 2.65Å; D378-H384 PolarHBondContact OD1-NE2 3.23Å; D378-H384 IonicContact OD2-CE1 2.95Å; D378-H384 PolarHBondContact OD2-CE1 2.92Å; D378-H384 IonicContact OD2-NE2 3.21Å; D378-H384 PolarHBondContact OD2-NE2 3.46Å
379	S	36.6	Very low	62.2	Low	118 Å²	118	86.3 Å²	86.3	83%	0.825	48%	0.484	S	S	*	.			trans	-90.1	85.4	153.1	56.2	0	0	0	0	108.5	Q377	Q377-S379 PolarHBondContact O-N 2.9Å
380	G	38.6	Very low	61.3	Low	77 Å²	77	83.8 Å²	83.8	79%	0.794	48%	0.475	S	S	*	.	S	Bend	trans	38.3	84	160.2	0	0	0	0	0	118.2
381	A	36.3	Very low	60.6	Low	80 Å²	80	84.8 Å²	84.8	66%	0.661	48%	0.48	S	S	*	.			trans	-145.3	124.8	158.1	0	0	0	0	0	110.7
382	E	35.7	Very low	60.1	Low	201 Å²	201	86.1 Å²	86.1	94%	0.939	49%	0.488	S	S	*	.	S	Bend	trans	-58.2	133.2	177.9	-63.5	169	145.2	0	0	111.6
383	G	36.1	Very low	59.5	Low	69 Å²	69	95.7 Å²	95.7	71%	0.711	52%	0.524	S	S	*	.			trans	94.8	74.9	163.5	0	0	0	0	0	115	S385	G383-S385 PolarHBondContact O-N 3.44Å
384	H	41.8	Very low	59.1	Low	99 Å²	99	96.4 Å²	96.4	46%	0.458	53%	0.53	S	S	.	.			trans	-68.5	75.4	172.6	-61.2	70	0	0	0	112.1	D378 H386	D378-H384 IonicContact OD1-NE2 2.65Å; D378-H384 PolarHBondContact OD1-NE2 3.23Å; D378-H384 IonicContact OD2-CE1 2.95Å; D378-H384 PolarHBondContact OD2-CE1 2.92Å; D378-H384 IonicContact OD2-NE2 3.21Å; D378-H384 PolarHBondContact OD2-NE2 3.46Å; H384-H386 PolarHBondContact O-N 3.26Å
385	S	42.7	Very low	59	Low	99 Å²	99	91.8 Å²	91.8	69%	0.692	52%	0.515	S	S	*	.			trans	-79.4	103.3	153.8	-170.3	0	0	0	0	106.6	G383 S387	G383-S385 PolarHBondContact O-N 3.44Å; S385-S387 VanDerWaalsContact C-N 3.26Å; S385-S387 PolarHBondContact O-N 2.67Å
386	H	50.1	Low	59.1	Low	51 Å²	51	90 Å²	90	24%	0.236	50%	0.503	C	S	.	.			trans	-57.8	98.5	164.4	-68.1	-76.5	0	0	0	107.2	F339 S341 H384 C388	F339-H386 HydrophobicContact CD1-CB 4.2Å; F339-H386 AromaticContact CD1-CD2 3.71Å; F339-H386 AromaticContact CD1-CG 3.71Å; F339-H386 AromaticContact CD1-ND1 3.95Å; F339-H386 AromaticContact CD1-NE2 3.96Å; F339-H386 HydrophobicContact CE1-CB 4.46Å; F339-H386 AromaticContact CE1-CE1 3.75Å; F339-H386 AromaticContact CE1-CG 3.84Å; F339-H386 AromaticContact CE1-ND1 3.6Å; S341-H386 PolarHBondContact OG-O 2.92Å; H384-H386 PolarHBondContact O-N 3.26Å; H386-C388 PolarHBondContact O-N 3.35Å
387	S	44.9	Very low	60.1	Low	64 Å²	64	82.4 Å²	82.4	45%	0.448	47%	0.474	S	S	.	.			trans	-43.5	133.7	175.6	168.6	0	0	0	0	109.6	S385 Y389 H390	S385-S387 VanDerWaalsContact C-N 3.26Å; S385-S387 PolarHBondContact O-N 2.67Å; S387-Y389 PolarHBondContact O-N 3.34Å; S387-Y389 PolarHBondContact OG-N 3.35Å; S387-H390 PolarHBondContact O-CE1 2.95Å
388	C	48.8	Very low	62	Low	95 Å²	95	74.9 Å²	74.9	64%	0.642	44%	0.438	S	S	*	.	S	Bend	trans	-63.5	-6.1	179.1	47.1	0	0	0	0	114.1	H386	H386-C388 PolarHBondContact O-N 3.35Å
389	Y	53.2	Low	64.1	Low	168 Å²	168	69.5 Å²	69.5	66%	0.659	41%	0.409	S	S	*	.			trans	-101.5	88.4	177.4	-61.8	-80.3	0	0	0	111	S387 D391 S394	S387-Y389 PolarHBondContact O-N 3.34Å; S387-Y389 PolarHBondContact OG-N 3.35Å; Y389-D391 PolarHBondContact O-N 3.31Å; Y389-S394 PolarHBondContact O-OG 3.26Å
390	H	73.7	Confident	66.8	Low	10 Å²	10	64.2 Å²	64.2	5%	0.046	37%	0.373	C	S	.	.			trans	-88.5	94	170.2	-57.1	-63.1	0	0	0	108.4	S387 F396 Y398	S387-H390 PolarHBondContact O-CE1 2.95Å; H390-F396 HydrophobicContact CB-CB 4.19Å; H390-F396 HydrophobicContact CB-CD1 3.88Å; H390-F396 HydrophobicContact CB-CD2 4.1Å; H390-F396 HydrophobicContact CB-CE1 4.27Å; H390-F396 HydrophobicContact CB-CE2 4.49Å; H390-F396 HydrophobicContact CB-CG 3.79Å; H390-F396 AromaticContact CE1-CZ 3.77Å; H390-F396 AromaticContact CG-CE1 3.97Å; H390-F396 AromaticContact ND1-CD1 3.85Å; H390-F396 AromaticContact ND1-CD2 3.9Å; H390-F396 AromaticContact ND1-CE1 3.32Å; H390-F396 VanDerWaalsContact ND1-CE1 3.32Å; H390-F396 WeakPolarHBondContact ND1-CE1 3.4Å; H390-F396 AromaticContact ND1-CE2 3.4Å; H390-F396 WeakPolarHBondContact ND1-CE2 3.36Å; H390-F396 AromaticContact ND1-CZ 3.09Å; H390-F396 WeakPolarHBondContact ND1-CZ 3.5Å; H390-Y398 HydrophobicContact CB-CE1 4.08Å; H390-Y398 VanDerWaalsContact O-CE1 3.31Å; H390-Y398 WeakPolarHBondContact O-CE1 3.28Å; H390-Y398 PolarHBondContact O-OH 3.13Å
391	D	82.6	Confident	69.2	Low	21 Å²	21	62 Å²	62	11%	0.112	34%	0.34	C	S	.	.	S	Bend	trans	-130.7	177.5	175.5	73.3	8.6	0	0	0	110.3	Y389 R393 S394 G395 F396	Y389-D391 PolarHBondContact O-N 3.31Å; D391-R393 PolarHBondContact O-N 2.85Å; D391-R393 WeakPolarHBondContact OD1-CA 3.32Å; D391-R393 VanDerWaalsContact OD1-CB 3.29Å; D391-R393 WeakPolarHBondContact OD1-CB 3.34Å; D391-R393 PolarHBondContact OD1-N 3.15Å; D391-R393 IonicContact OD1-NE 2.76Å; D391-R393 IonicContact OD2-CZ 3.66Å; D391-R393 VanDerWaalsContact OD2-CZ 3.27Å; D391-R393 IonicContact OD2-NE 2.67Å; D391-R393 PolarHBondContact OD2-NE 3.25Å; D391-R393 IonicContact OD2-NH2 3.89Å; D391-R393 PolarHBondContact OD2-NH2 3.47Å; D391-S394 PolarHBondContact N-OG 2.69Å; D391-S394 PolarHBondContact O-N 3.23Å; D391-S394 VanDerWaalsContact O-N 3.14Å; D391-S394 PolarHBondContact O-OG 2.79Å; D391-S394 VanDerWaalsContact O-OG 3.13Å; D391-S394 PolarHBondContact OD1-N 3.27Å; D391-G395 PolarHBondContact O-N 3.49Å; D391-F396 CarbonylContact C-O 3.57Å; D391-F396 VanDerWaalsContact C-O 3.24Å; D391-F396 PolarHBondContact O-N 3.5Å
392	T	86.8	Confident	71.1	Confident	27 Å²	27	60.9 Å²	60.9	17%	0.166	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-59.4	-30	179.8	53.7	0	0	0	0	113.1	G395 F396 W397 S413 D414 F453	T392-G395 PolarHBondContact O-N 3.45Å; T392-F396 VanDerWaalsContact CA-O 3.29Å; T392-F396 WeakPolarHBondContact CA-O 3.06Å; T392-F396 PolarHBondContact N-O 3.4Å; T392-W397 HydrophobicContact CG2-CG 4.41Å; T392-S413 WeakPolarHBondContact CG2-OG 3.44Å; T392-S413 PolarHBondContact N-O 3.5Å; T392-D414 HydrophobicContact CG2-CB 4.14Å; T392-F453 HydrophobicContact CG2-CD1 4Å; T392-F453 HydrophobicContact CG2-CE1 3.6Å
393	R	85.3	Confident	72.9	Confident	202 Å²	202	55.6 Å²	55.6	76%	0.762	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-72.6	-31.5	179.2	-57.8	175.7	-70.4	-158.6	-3.9	112	D391 G395	D391-R393 PolarHBondContact O-N 2.85Å; D391-R393 WeakPolarHBondContact OD1-CA 3.32Å; D391-R393 VanDerWaalsContact OD1-CB 3.29Å; D391-R393 WeakPolarHBondContact OD1-CB 3.34Å; D391-R393 PolarHBondContact OD1-N 3.15Å; D391-R393 IonicContact OD1-NE 2.76Å; D391-R393 IonicContact OD2-CZ 3.66Å; D391-R393 VanDerWaalsContact OD2-CZ 3.27Å; D391-R393 IonicContact OD2-NE 2.67Å; D391-R393 PolarHBondContact OD2-NE 3.25Å; D391-R393 IonicContact OD2-NH2 3.89Å; D391-R393 PolarHBondContact OD2-NH2 3.47Å; R393-G395 VanDerWaalsContact C-N 3.28Å
394	S	85	Confident	74.3	Confident	27 Å²	27	53.7 Å²	53.7	19%	0.189	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-85.6	0.5	175.1	64.8	0	0	0	0	114	R376 Y389 D391 F396	R376-S394 PolarHBondContact NH2-O 3.3Å; Y389-S394 PolarHBondContact O-OG 3.26Å; D391-S394 PolarHBondContact N-OG 2.69Å; D391-S394 PolarHBondContact O-N 3.23Å; D391-S394 VanDerWaalsContact O-N 3.14Å; D391-S394 PolarHBondContact O-OG 2.79Å; D391-S394 VanDerWaalsContact O-OG 3.13Å; D391-S394 PolarHBondContact OD1-N 3.27Å; S394-F396 WeakPolarHBondContact OG-CD2 3.39Å
395	G	90.9	Very high	75.2	Confident	8 Å²	8	56.5 Å²	56.5	8%	0.082	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	25.7	176	0	0	0	0	0	114.2	V373 R374 D391 T392 R393 W397	V373-G395 CarbonylContact C-O 3.54Å; V373-G395 WeakPolarHBondContact CA-O 3.37Å; R374-G395 PolarHBondContact N-O 3.4Å; D391-G395 PolarHBondContact O-N 3.49Å; T392-G395 PolarHBondContact O-N 3.45Å; R393-G395 VanDerWaalsContact C-N 3.28Å; G395-W397 VanDerWaalsContact C-CZ3 3.5Å; G395-W397 WeakPolarHBondContact O-CZ3 3.29Å
396	F	92.8	Very high	76.2	Confident	12 Å²	12	61.6 Å²	61.6	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.3	179.2	-68	-103.3	0	0	0	110.6	V373 H390 D391 T392 S394 Y398 S413 Y463	V373-F396 HydrophobicContact CB-CD1 3.9Å; V373-F396 HydrophobicContact CB-CE1 3.89Å; V373-F396 HydrophobicContact CB-CG 4.47Å; V373-F396 HydrophobicContact CB-CZ 4.44Å; V373-F396 HydrophobicContact CG2-CD1 3.62Å; V373-F396 HydrophobicContact CG2-CD2 4.05Å; V373-F396 HydrophobicContact CG2-CE1 3.34Å; V373-F396 HydrophobicContact CG2-CE2 3.79Å; V373-F396 HydrophobicContact CG2-CG 3.97Å; V373-F396 HydrophobicContact CG2-CZ 3.41Å; V373-F396 VanDerWaalsContact CG2-CZ 3.41Å; H390-F396 HydrophobicContact CB-CB 4.19Å; H390-F396 HydrophobicContact CB-CD1 3.88Å; H390-F396 HydrophobicContact CB-CD2 4.1Å; H390-F396 HydrophobicContact CB-CE1 4.27Å; H390-F396 HydrophobicContact CB-CE2 4.49Å; H390-F396 HydrophobicContact CB-CG 3.79Å; H390-F396 AromaticContact CE1-CZ 3.77Å; H390-F396 AromaticContact CG-CE1 3.97Å; H390-F396 AromaticContact ND1-CD1 3.85Å; H390-F396 AromaticContact ND1-CD2 3.9Å; H390-F396 AromaticContact ND1-CE1 3.32Å; H390-F396 VanDerWaalsContact ND1-CE1 3.32Å; H390-F396 WeakPolarHBondContact ND1-CE1 3.4Å; H390-F396 AromaticContact ND1-CE2 3.4Å; H390-F396 WeakPolarHBondContact ND1-CE2 3.36Å; H390-F396 AromaticContact ND1-CZ 3.09Å; H390-F396 WeakPolarHBondContact ND1-CZ 3.5Å; D391-F396 CarbonylContact C-O 3.57Å; D391-F396 VanDerWaalsContact C-O 3.24Å; D391-F396 PolarHBondContact O-N 3.5Å; T392-F396 VanDerWaalsContact CA-O 3.29Å; T392-F396 WeakPolarHBondContact CA-O 3.06Å; T392-F396 PolarHBondContact N-O 3.4Å; S394-F396 WeakPolarHBondContact OG-CD2 3.39Å; F396-Y398 HydrophobicContact CB-CD1 4.11Å; F396-Y398 HydrophobicContact CB-CE1 4.19Å; F396-S413 WeakPolarHBondContact O-CB 3.44Å; F396-S413 PolarHBondContact O-OG 3.04Å; F396-Y463 HydrophobicContact CD1-CD1 4.32Å; F396-Y463 HydrophobicContact CD1-CD2 4.07Å; F396-Y463 HydrophobicContact CD1-CE1 4.26Å; F396-Y463 HydrophobicContact CD1-CE2 4Å; F396-Y463 HydrophobicContact CD1-CG 4.23Å; F396-Y463 AromaticContact CE1-CD2 3.92Å; F396-Y463 HydrophobicContact CE1-CD2 3.92Å; F396-Y463 AromaticContact CE1-CE2 3.73Å; F396-Y463 HydrophobicContact CE1-CE2 3.73Å
397	W	95.8	Very high	77.3	Confident	13 Å²	13	60.8 Å²	60.8	5%	0.049	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	108	176.1	-59.1	-91.3	0	0	0	108.9	G371 V372 R374 T392 G395 S413 L439 F453 A455 F457 V460	G371-W397 CarbonylContact C-O 3.56Å; G371-W397 WeakPolarHBondContact CA-O 3.33Å; V372-W397 HydrophobicContact CG2-CB 4.2Å; V372-W397 HydrophobicContact CG2-CE3 4.05Å; V372-W397 PolarHBondContact N-O 3.37Å; V372-W397 PolarHBondContact O-N 2.82Å; R374-W397 HydrophobicContact CB-CH2 4.25Å; R374-W397 HydrophobicContact CB-CZ3 3.96Å; T392-W397 HydrophobicContact CG2-CG 4.41Å; G395-W397 VanDerWaalsContact C-CZ3 3.5Å; G395-W397 WeakPolarHBondContact O-CZ3 3.29Å; W397-S413 WeakPolarHBondContact CA-OG 3.25Å; W397-L439 HydrophobicContact CB-CD2 3.52Å; W397-F453 HydrophobicContact CB-CD2 4.25Å; W397-F453 HydrophobicContact CB-CE2 4.36Å; W397-F453 HydrophobicContact CB-CG 4.31Å; W397-F453 AromaticContact CD1-CD1 3.65Å; W397-F453 AromaticContact CD1-CG 3.91Å; W397-F453 HydrophobicContact CG-CD1 4.49Å; W397-A455 HydrophobicContact CZ2-CB 4.38Å; W397-F457 HydrophobicContact CB-CE1 4.41Å; W397-F457 AromaticContact CD1-CE1 3.81Å; W397-F457 AromaticContact CD2-CD1 3.61Å; W397-F457 HydrophobicContact CD2-CD1 3.61Å; W397-F457 AromaticContact CD2-CE1 3.72Å; W397-F457 HydrophobicContact CD2-CE1 3.72Å; W397-F457 AromaticContact CE2-CD1 3.7Å; W397-F457 AromaticContact CE2-CE1 3.82Å; W397-F457 AromaticContact CE3-CD1 3.77Å; W397-F457 HydrophobicContact CE3-CD1 3.77Å; W397-F457 HydrophobicContact CE3-CE1 4.31Å; W397-F457 HydrophobicContact CG-CD1 4.14Å; W397-F457 AromaticContact CG-CE1 3.74Å; W397-F457 HydrophobicContact CG-CE1 3.74Å; W397-F457 HydrophobicContact CH2-CD1 4.14Å; W397-F457 AromaticContact CZ2-CD1 3.98Å; W397-F457 HydrophobicContact CZ2-CD1 3.98Å; W397-F457 HydrophobicContact CZ2-CE1 4.49Å; W397-F457 HydrophobicContact CZ3-CD1 4.02Å; W397-F457 AromaticContact NE1-CE1 3.84Å; W397-V460 HydrophobicContact CZ3-CG1 4.28Å
398	Y	95.1	Very high	79	Confident	18 Å²	18	60.2 Å²	60.2	7%	0.071	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	161.1	-177.2	64.4	-107.9	0	0	0	112.7	R369 V370 H390 F396 C400 T412 S413 Y463	R369-Y398 HydrophobicContact CB-CD2 3.89Å; R369-Y398 HydrophobicContact CB-CE2 4.26Å; R369-Y398 HydrophobicContact CB-CG 4.17Å; R369-Y398 HydrophobicContact CG-CD2 4.29Å; R369-Y398 HydrophobicContact CG-CE2 4.15Å; V370-Y398 VanDerWaalsContact O-CA 3.31Å; V370-Y398 WeakPolarHBondContact O-CA 3.41Å; V370-Y398 VanDerWaalsContact O-CB 3.26Å; V370-Y398 WeakPolarHBondContact O-CB 3.48Å; H390-Y398 HydrophobicContact CB-CE1 4.08Å; H390-Y398 VanDerWaalsContact O-CE1 3.31Å; H390-Y398 WeakPolarHBondContact O-CE1 3.28Å; H390-Y398 PolarHBondContact O-OH 3.13Å; F396-Y398 HydrophobicContact CB-CD1 4.11Å; F396-Y398 HydrophobicContact CB-CE1 4.19Å; Y398-C400 HydrophobicContact CD2-CB 4.02Å; Y398-C400 HydrophobicContact CE2-CB 3.96Å; Y398-T412 CarbonylContact O-C 3.56Å; Y398-T412 WeakPolarHBondContact O-CA 3.3Å; Y398-S413 PolarHBondContact N-OG 3.48Å; Y398-S413 PolarHBondContact O-N 3.32Å; Y398-Y463 HydrophobicContact CD1-CD1 4.07Å; Y398-Y463 AromaticContact CD1-CE1 3.81Å; Y398-Y463 HydrophobicContact CD1-CE1 3.81Å; Y398-Y463 HydrophobicContact CE1-CE1 4.23Å; Y398-Y463 HydrophobicContact CG-CE1 4.4Å
399	V	94.4	Very high	80.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142.4	162.4	175.8	0	0	0	0	108.5	W368 R369 V370 C410 V411 L420 F441	W368-V399 HydrophobicContact CH2-CG1 4.29Å; W368-V399 HydrophobicContact CZ3-CG1 4.34Å; W368-V399 WeakPolarHBondContact CZ3-O 3.29Å; R369-V399 WeakPolarHBondContact CA-O 3.37Å; V370-V399 PolarHBondContact N-O 2.94Å; V370-V399 PolarHBondContact O-N 3.5Å; V399-C410 HydrophobicContact CG1-CB 4.21Å; V399-V411 WeakPolarHBondContact CA-O 3.48Å; V399-L420 HydrophobicContact CG1-CD1 4.33Å; V399-F441 HydrophobicContact CB-CD1 4.21Å; V399-F441 HydrophobicContact CB-CE1 4.42Å; V399-F441 HydrophobicContact CB-CG 4.37Å; V399-F441 HydrophobicContact CG2-CB 4Å; V399-F441 HydrophobicContact CG2-CD1 3.86Å; V399-F441 HydrophobicContact CG2-CD2 3.62Å; V399-F441 HydrophobicContact CG2-CE1 4.2Å; V399-F441 HydrophobicContact CG2-CE2 4Å; V399-F441 HydrophobicContact CG2-CG 3.54Å; V399-F441 HydrophobicContact CG2-CZ 4.26Å
400	C	91.5	Very high	82.4	Confident	8 Å²	8	50.2 Å²	50.2	5%	0.054	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.9	176.9	73.7	0	0	0	0	113.4	W368 R369 Y398 C410 V411	W368-C400 VanDerWaalsContact O-CA 3.24Å; W368-C400 WeakPolarHBondContact O-CA 3.11Å; W368-C400 WeakPolarHBondContact O-CB 3.29Å; R369-C400 HydrophobicContact CB-CB 3.89Å; R369-C400 HydrophobicContact CG-CB 3.52Å; Y398-C400 HydrophobicContact CD2-CB 4.02Å; Y398-C400 HydrophobicContact CE2-CB 3.96Å; C400-C410 CarbonylContact O-C 3.59Å; C400-C410 VanDerWaalsContact O-CA 3.26Å; C400-C410 WeakPolarHBondContact O-CA 3.45Å; C400-V411 PolarHBondContact N-O 2.82Å; C400-V411 PolarHBondContact O-N 3.42Å; C400-V411 WeakPolarHBondContact SG-CG2 3.39Å
401	R	89.9	Confident	83.1	Confident	30 Å²	30	51.2 Å²	51.2	11%	0.113	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.9	166.7	178.2	-176.9	179.8	167.6	5.5	109.2	L365 Q366 W368 D408 I424	L365-R401 WeakPolarHBondContact O-CD 3.38Å; L365-R401 PolarHBondContact O-NH1 3.47Å; Q366-R401 WeakPolarHBondContact O-CD 3.48Å; W368-R401 HydrophobicContact CD2-CB 4.09Å; W368-R401 VanDerWaalsContact CE2-CB 3.49Å; W368-R401 HydrophobicContact CG-CB 4.36Å; W368-R401 HydrophobicContact CZ2-CB 3.81Å; W368-R401 PolarHBondContact O-N 3.09Å; W368-R401 VanDerWaalsContact O-N 3.17Å; R401-D408 IonicContact CZ-OD2 3.91Å; R401-D408 IonicContact NE-OD2 3.55Å; R401-D408 PolarHBondContact NE-OD2 3.23Å; R401-D408 IonicContact NH2-OD2 3.94Å; R401-D408 PolarHBondContact NH2-OD2 3.03Å; R401-I424 HydrophobicContact CG-CD1 4.31Å; R401-I424 HydrophobicContact CG-CG2 4.32Å
402	T	75.8	Confident	83.6	Confident	56 Å²	56	50.8 Å²	50.8	34%	0.344	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	139	176.2	-58.7	0	0	0	0	109.7	D408 H409 V411	T402-D408 WeakPolarHBondContact O-CA 3.07Å; T402-H409 PolarHBondContact N-O 3.09Å; T402-H409 PolarHBondContact O-N 3.39Å; T402-H409 VanDerWaalsContact O-N 3.17Å; T402-V411 WeakPolarHBondContact OG1-CG2 3.23Å
403	Q	73	Confident	83.8	Confident	90 Å²	90	49.8 Å²	49.8	42%	0.421	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114	173.6	-65.1	-172.6	-24.4	0	0	109.4	D408	Q403-D408 WeakPolarHBondContact CA-OD1 3.17Å; Q403-D408 WeakPolarHBondContact CG-OD1 3.35Å
404	G	65.9	Low	83.9	Confident	29 Å²	29	42.3 Å²	42.3	30%	0.299	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	164.3	178.3	0	0	0	0	0	113	E406 G407	G404-E406 VanDerWaalsContact C-N 3.3Å; G404-E406 PolarHBondContact O-N 2.96Å; G404-G407 WeakPolarHBondContact CA-O 3.5Å; G404-G407 PolarHBondContact N-O 3.04Å; G404-G407 PolarHBondContact O-N 2.88Å
405	V	61.8	Low	83.5	Confident	158 Å²	158	45.4 Å²	45.4	96%	0.958	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-32	176.9	-175.5	0	0	0	0	111.8	G407	V405-G407 VanDerWaalsContact C-N 3.31Å
406	E	63.6	Low	83	Confident	206 Å²	206	49.4 Å²	49.4	96%	0.963	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	6.5	177.5	-61.8	-175.6	163.3	0	0	113.1	G404	G404-E406 VanDerWaalsContact C-N 3.3Å; G404-E406 PolarHBondContact O-N 2.96Å
407	G	72	Confident	82.4	Confident	34 Å²	34	50.6 Å²	50.6	35%	0.351	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	117.1	168.8	-175.5	0	0	0	0	0	113.4	G404 V405 H409	G404-G407 WeakPolarHBondContact CA-O 3.5Å; G404-G407 PolarHBondContact N-O 3.04Å; G404-G407 PolarHBondContact O-N 2.88Å; V405-G407 VanDerWaalsContact C-N 3.31Å; G407-H409 PolarHBondContact O-ND1 2.99Å; G407-H409 VanDerWaalsContact O-ND1 3.11Å
408	D	81.4	Confident	81.4	Confident	52 Å²	52	54.2 Å²	54.2	28%	0.278	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.6	178.8	-73.8	11.8	0	0	0	110.8	R401 T402 Q403 I424	R401-D408 IonicContact CZ-OD2 3.91Å; R401-D408 IonicContact NE-OD2 3.55Å; R401-D408 PolarHBondContact NE-OD2 3.23Å; R401-D408 IonicContact NH2-OD2 3.94Å; R401-D408 PolarHBondContact NH2-OD2 3.03Å; T402-D408 WeakPolarHBondContact O-CA 3.07Å; Q403-D408 WeakPolarHBondContact CA-OD1 3.17Å; Q403-D408 WeakPolarHBondContact CG-OD1 3.35Å; D408-I424 HydrophobicContact CB-CD1 3.37Å
409	H	83.9	Confident	80.6	Confident	51 Å²	51	56.5 Å²	56.5	24%	0.236	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	164.4	-179.4	55.3	-86.2	0	0	0	110.7	T402 G407 V411	T402-H409 PolarHBondContact N-O 3.09Å; T402-H409 PolarHBondContact O-N 3.39Å; T402-H409 VanDerWaalsContact O-N 3.17Å; G407-H409 PolarHBondContact O-ND1 2.99Å; G407-H409 VanDerWaalsContact O-ND1 3.11Å; H409-V411 VanDerWaalsContact CD2-CG1 3.43Å; H409-V411 WeakPolarHBondContact CD2-CG1 3.43Å
410	C	89	Confident	80	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.02	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	140.2	174.1	-72.6	0	0	0	0	110.6	V399 C400 L420	V399-C410 HydrophobicContact CG1-CB 4.21Å; C400-C410 CarbonylContact O-C 3.59Å; C400-C410 VanDerWaalsContact O-CA 3.26Å; C400-C410 WeakPolarHBondContact O-CA 3.45Å; C410-L420 HydrophobicContact CB-CB 4.11Å; C410-L420 HydrophobicContact CB-CD1 4.12Å; C410-L420 WeakPolarHBondContact O-CB 3.42Å; C410-L420 PolarHBondContact O-N 3.49Å
411	V	89.6	Confident	78.7	Confident	30 Å²	30	63.7 Å²	63.7	18%	0.182	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	161.9	172.1	-56	0	0	0	0	109.4	V399 C400 T402 H409 P419	V399-V411 WeakPolarHBondContact CA-O 3.48Å; C400-V411 PolarHBondContact N-O 2.82Å; C400-V411 PolarHBondContact O-N 3.42Å; C400-V411 WeakPolarHBondContact SG-CG2 3.39Å; T402-V411 WeakPolarHBondContact OG1-CG2 3.23Å; H409-V411 VanDerWaalsContact CD2-CG1 3.43Å; H409-V411 WeakPolarHBondContact CD2-CG1 3.43Å; V411-P419 HydrophobicContact CG1-CB 4.42Å; V411-P419 HydrophobicContact CG1-CG 4.47Å
412	T	92	Very high	77.7	Confident	13 Å²	13	66 Å²	66	8%	0.08	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	164.2	177	83.9	0	0	0	0	110	Y398 D414 T417 L420 Y451	Y398-T412 CarbonylContact O-C 3.56Å; Y398-T412 WeakPolarHBondContact O-CA 3.3Å; T412-D414 PolarHBondContact O-N 2.91Å; T412-D414 WeakPolarHBondContact OG1-CB 3.31Å; T412-D414 PolarHBondContact OG1-N 2.96Å; T412-D414 VanDerWaalsContact OG1-N 3.13Å; T412-D414 PolarHBondContact OG1-O 3.37Å; T412-T417 HydrophobicContact CG2-CG2 4.01Å; T412-L420 HydrophobicContact CG2-CD1 4.02Å; T412-L420 HydrophobicContact CG2-CD2 4.12Å; T412-L420 HydrophobicContact CG2-CG 4.21Å; T412-Y451 HydrophobicContact CG2-CD1 3.67Å; T412-Y451 HydrophobicContact CG2-CD2 3.89Å; T412-Y451 HydrophobicContact CG2-CE1 3.92Å; T412-Y451 HydrophobicContact CG2-CE2 4.13Å; T412-Y451 HydrophobicContact CG2-CG 3.63Å
413	S	90.8	Very high	77.9	Confident	5 Å²	5	65.3 Å²	65.3	4%	0.035	40%	0.4	C	S	.	.	S	Bend	trans	-73.6	-2.1	171.5	65.1	0	0	0	0	114	T392 F396 W397 Y398 P415	T392-S413 WeakPolarHBondContact CG2-OG 3.44Å; T392-S413 PolarHBondContact N-O 3.5Å; F396-S413 WeakPolarHBondContact O-CB 3.44Å; F396-S413 PolarHBondContact O-OG 3.04Å; W397-S413 WeakPolarHBondContact CA-OG 3.25Å; Y398-S413 PolarHBondContact N-OG 3.48Å; Y398-S413 PolarHBondContact O-N 3.32Å; S413-P415 WeakPolarHBondContact O-CD 3.33Å
414	D	87.4	Confident	78.6	Confident	46 Å²	46	63.2 Å²	63.2	25%	0.246	39%	0.391	C	S	.	.			trans	-84	112.9	170.4	-170.2	-16.3	0	0	0	110.1	T392 T412 A416 T417 F453	T392-D414 HydrophobicContact CG2-CB 4.14Å; T412-D414 PolarHBondContact O-N 2.91Å; T412-D414 WeakPolarHBondContact OG1-CB 3.31Å; T412-D414 PolarHBondContact OG1-N 2.96Å; T412-D414 VanDerWaalsContact OG1-N 3.13Å; T412-D414 PolarHBondContact OG1-O 3.37Å; D414-A416 PolarHBondContact O-N 3.36Å; D414-A416 WeakPolarHBondContact OD1-CB 3.08Å; D414-A416 PolarHBondContact OD1-N 3.36Å; D414-T417 PolarHBondContact O-N 3.24Å; D414-T417 VanDerWaalsContact O-N 3.15Å; D414-F453 HydrophobicContact CB-CE1 3.98Å
415	P	76.4	Confident	79.8	Confident	91 Å²	91	62 Å²	62	59%	0.591	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.2	-178.8	-17.9	31.2	0	0	0	114	S413 T417	S413-P415 WeakPolarHBondContact O-CD 3.33Å; P415-T417 VanDerWaalsContact C-N 3.29Å
416	A	79.9	Confident	81.3	Confident	92 Å²	92	61.6 Å²	61.6	76%	0.76	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.7	179.1	0	0	0	0	0	112.8	D414	D414-A416 PolarHBondContact O-N 3.36Å; D414-A416 WeakPolarHBondContact OD1-CB 3.08Å; D414-A416 PolarHBondContact OD1-N 3.36Å
417	T	80.4	Confident	82.8	Confident	37 Å²	37	56.1 Å²	56.1	23%	0.227	33%	0.33	C	S	.	.	S	Bend	trans	-88	127.5	-174.3	-56.7	0	0	0	0	110.8	T412 D414 P415 L420 Y451	T412-T417 HydrophobicContact CG2-CG2 4.01Å; D414-T417 PolarHBondContact O-N 3.24Å; D414-T417 VanDerWaalsContact O-N 3.15Å; P415-T417 VanDerWaalsContact C-N 3.29Å; T417-L420 HydrophobicContact CG2-CD2 4.5Å; T417-Y451 HydrophobicContact CG2-CD2 4.25Å; T417-Y451 HydrophobicContact CG2-CE2 3.57Å; T417-Y451 PolarHBondContact OG1-OH 2.82Å
418	S	76	Confident	83.9	Confident	90 Å²	90	54.5 Å²	54.5	63%	0.629	31%	0.313	S	S	*	.			trans	-63.3	155.9	172.6	56.6	0	0	0	0	111.6	L420	S418-L420 PolarHBondContact O-N 3.23Å
419	P	78.5	Confident	84.7	Confident	66 Å²	66	56.6 Å²	56.6	43%	0.429	32%	0.317	S	S	.	.			trans	-45.4	134.8	170.4	-32.1	38.4	0	0	0	113.1	V411 V421	V411-P419 HydrophobicContact CG1-CB 4.42Å; V411-P419 HydrophobicContact CG1-CG 4.47Å; P419-V421 PolarHBondContact O-N 2.88Å
420	L	80.2	Confident	85.4	Confident	18 Å²	18	54.1 Å²	54.1	9%	0.094	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-73.3	110.4	175.3	-54.3	179.7	0	0	0	107.5	V399 C410 T412 T417 S418 L422 L450 Y451	V399-L420 HydrophobicContact CG1-CD1 4.33Å; C410-L420 HydrophobicContact CB-CB 4.11Å; C410-L420 HydrophobicContact CB-CD1 4.12Å; C410-L420 WeakPolarHBondContact O-CB 3.42Å; C410-L420 PolarHBondContact O-N 3.49Å; T412-L420 HydrophobicContact CG2-CD1 4.02Å; T412-L420 HydrophobicContact CG2-CD2 4.12Å; T412-L420 HydrophobicContact CG2-CG 4.21Å; T417-L420 HydrophobicContact CG2-CD2 4.5Å; S418-L420 PolarHBondContact O-N 3.23Å; L420-L422 PolarHBondContact O-N 3.34Å; L420-L450 HydrophobicContact CD1-CB 4.48Å; L420-Y451 HydrophobicContact CD2-CD2 4.05Å
421	V	64.6	Low	85.8	Confident	140 Å²	140	56.4 Å²	56.4	85%	0.848	32%	0.316	S	S	*	.			trans	-80.6	71.5	179.4	-172.4	0	0	0	0	109.3	P419	P419-V421 PolarHBondContact O-N 2.88Å
422	L	68.6	Low	86.2	Confident	79 Å²	79	55.1 Å²	55.1	41%	0.414	31%	0.308	S	S	.	.	S	Bend	trans	-141.3	154	-179.6	-68.2	171.3	0	0	0	109.7	L420 L450	L420-L422 PolarHBondContact O-N 3.34Å; L422-L450 HydrophobicContact CB-CD2 4.38Å; L422-L450 HydrophobicContact CD1-CD2 3.49Å; L422-L450 VanDerWaalsContact CD1-CD2 3.49Å
423	A	80.4	Confident	86.5	Confident	41 Å²	41	56.8 Å²	56.8	34%	0.339	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-62.7	148.3	173.8	0	0	0	0	0	110.5	P425	A423-P425 WeakPolarHBondContact O-CD 3.22Å
424	I	88.1	Confident	86.6	Confident	47 Å²	47	57.8 Å²	57.8	24%	0.241	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-69.8	120.1	-176.3	-56.9	169.2	0	0	0	109	W368 R401 D408	W368-I424 HydrophobicContact CZ2-CG2 4.33Å; R401-I424 HydrophobicContact CG-CD1 4.31Å; R401-I424 HydrophobicContact CG-CG2 4.32Å; D408-I424 HydrophobicContact CB-CD1 3.37Å
425	P	91.3	Very high	86.9	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.019	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-69.2	137.2	-178.4	27.8	-34.1	0	0	0	110.4	L362 W368 A423 L428 D443 L450	L362-P425 HydrophobicContact CD1-CG 4.38Å; W368-P425 HydrophobicContact CH2-CG 4.2Å; W368-P425 HydrophobicContact CZ2-CG 4.23Å; A423-P425 WeakPolarHBondContact O-CD 3.22Å; P425-L428 HydrophobicContact CG-CD1 3.92Å; P425-D443 HydrophobicContact CB-CB 4.08Å; P425-L450 HydrophobicContact CG-CD1 4.09Å
426	R	92.6	Very high	87.6	Confident	149 Å²	149	63.7 Å²	63.7	56%	0.562	34%	0.34	S	S	*	.	S	Bend	trans	-83.1	-19.9	168.8	-60.5	-171.6	73.4	-162.4	2.2	112.2	L362 G363	L362-R426 WeakPolarHBondContact CA-O 3.43Å; L362-R426 WeakPolarHBondContact CB-O 3.26Å; L362-R426 PolarHBondContact N-O 2.95Å; G363-R426 PolarHBondContact N-O 3.44Å; G363-R426 VanDerWaalsContact N-O 3.12Å
427	R	95.3	Very high	88.3	Confident	91 Å²	91	59.5 Å²	59.5	34%	0.343	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	123.4	176.9	-164.9	-172.3	-26.1	-179.3	7.6	109.3	E359 V360 A444 E445	E359-R427 WeakPolarHBondContact OE2-CD 3.45Å; V360-R427 VanDerWaalsContact O-CA 3.32Å; V360-R427 WeakPolarHBondContact O-CA 3.43Å; R427-A444 HydrophobicContact CB-CB 4.07Å; R427-A444 HydrophobicContact CG-CB 3.89Å; R427-A444 PolarHBondContact O-N 3.45Å; R427-E445 HydrophobicContact CB-CG 4.03Å; R427-E445 IonicContact CZ-OE1 2.95Å; R427-E445 IonicContact NE-OE1 3.1Å; R427-E445 IonicContact NH2-OE1 3.53Å; R427-E445 PolarHBondContact NH2-OE1 3.38Å; R427-E445 VanDerWaalsContact NH2-OE1 3.09Å
428	L	96.4	Very high	89.1	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.9	-176.1	-170	76.1	0	0	0	109.1	E359 V360 L362 W368 V370 P425 V430 F441 L450	E359-L428 CarbonylContact C-O 3.54Å; E359-L428 WeakPolarHBondContact CA-O 3.48Å; V360-L428 PolarHBondContact N-O 3.33Å; V360-L428 PolarHBondContact O-N 3.3Å; L362-L428 HydrophobicContact CD1-CB 3.76Å; L362-L428 HydrophobicContact CG-CB 4.46Å; W368-L428 HydrophobicContact CH2-CD2 4.47Å; W368-L428 HydrophobicContact CZ3-CD2 4.08Å; V370-L428 HydrophobicContact CB-CD2 3.68Å; V370-L428 HydrophobicContact CG1-CD2 3.88Å; V370-L428 HydrophobicContact CG2-CD2 4.28Å; P425-L428 HydrophobicContact CG-CD1 3.92Å; L428-V430 HydrophobicContact CD2-CG2 4.43Å; L428-F441 HydrophobicContact CD1-CB 4.49Å; L428-F441 HydrophobicContact CD2-CD1 3.91Å; L428-F441 HydrophobicContact CD2-CE1 4.39Å; L428-F441 HydrophobicContact CG-CD1 4.32Å; L428-L450 HydrophobicContact CD1-CD1 3.39Å
429	R	97.3	Very high	90.2	Very high	96 Å²	96	57.1 Å²	57.1	36%	0.362	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.9	169.1	177.9	172.5	172.8	148.9	-6.5	109.1	W358 E359 E431 F441 Y442 A444	W358-R429 WeakPolarHBondContact O-CA 3.43Å; E359-R429 HydrophobicContact CG-CB 3.89Å; E359-R429 HydrophobicContact CG-CG 4.12Å; R429-E431 HydrophobicContact CG-CG 4.28Å; R429-E431 IonicContact CZ-OE1 2.69Å; R429-E431 IonicContact NE-OE1 3.92Å; R429-E431 PolarHBondContact NE-OE1 3.31Å; R429-E431 IonicContact NH2-OE1 3.49Å; R429-E431 PolarHBondContact NH2-OE1 2.81Å; R429-F441 WeakPolarHBondContact O-CA 3.49Å; R429-Y442 HydrophobicContact CG-CD2 4.48Å; R429-Y442 PolarHBondContact N-O 2.87Å; R429-Y442 PolarHBondContact O-N 3.49Å; R429-A444 HydrophobicContact CB-CB 4.16Å
430	V	98.1	Very high	91.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.4	175.9	-171.3	0	0	0	0	107.9	A357 W358 V370 L428 L439 S440 F441	A357-V430 VanDerWaalsContact CA-O 3.26Å; A357-V430 WeakPolarHBondContact CA-O 3.41Å; W358-V430 HydrophobicContact CD2-CB 3.98Å; W358-V430 HydrophobicContact CD2-CG1 4.45Å; W358-V430 HydrophobicContact CE3-CB 4.49Å; W358-V430 HydrophobicContact CG-CB 4.45Å; W358-V430 HydrophobicContact CH2-CB 4.25Å; W358-V430 HydrophobicContact CH2-CG1 3.67Å; W358-V430 HydrophobicContact CZ2-CB 3.73Å; W358-V430 HydrophobicContact CZ2-CG1 3.4Å; W358-V430 VanDerWaalsContact CZ2-CG1 3.4Å; W358-V430 HydrophobicContact CZ2-CG2 4.25Å; W358-V430 HydrophobicContact CZ3-CG1 4.3Å; W358-V430 PolarHBondContact N-O 2.97Å; W358-V430 PolarHBondContact O-N 2.96Å; V370-V430 HydrophobicContact CG1-CG2 3.86Å; L428-V430 HydrophobicContact CD2-CG2 4.43Å; V430-L439 HydrophobicContact CG1-CD1 3.62Å; V430-S440 WeakPolarHBondContact CA-O 3.37Å; V430-F441 HydrophobicContact CB-CE1 4.47Å; V430-F441 HydrophobicContact CG1-CD1 4.34Å; V430-F441 HydrophobicContact CG1-CE1 3.94Å; V430-F441 HydrophobicContact CG1-CZ 4.33Å; V430-F441 HydrophobicContact CG2-CD1 3.9Å; V430-F441 HydrophobicContact CG2-CE1 3.82Å
431	E	98.1	Very high	91.9	Very high	51 Å²	51	53.5 Å²	53.5	24%	0.238	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.3	175.2	-62	-175.2	161	0	0	108.7	H356 A357 R429 L439 S440 Y442	H356-E431 CarbonylContact O-C 3.55Å; H356-E431 WeakPolarHBondContact O-CA 3.33Å; A357-E431 HydrophobicContact CB-CG 4.15Å; R429-E431 HydrophobicContact CG-CG 4.28Å; R429-E431 IonicContact CZ-OE1 2.69Å; R429-E431 IonicContact NE-OE1 3.92Å; R429-E431 PolarHBondContact NE-OE1 3.31Å; R429-E431 IonicContact NH2-OE1 3.49Å; R429-E431 PolarHBondContact NH2-OE1 2.81Å; E431-L439 CarbonylContact O-C 3.48Å; E431-L439 WeakPolarHBondContact O-CA 3.3Å; E431-S440 PolarHBondContact N-O 2.77Å; E431-S440 PolarHBondContact O-N 3.08Å; E431-Y442 HydrophobicContact CB-CE2 4.31Å; E431-Y442 HydrophobicContact CG-CD2 4.36Å; E431-Y442 HydrophobicContact CG-CE2 3.92Å; E431-Y442 WeakPolarHBondContact OE2-CE2 3.49Å; E431-Y442 PolarHBondContact OE2-OH 2.89Å
432	L	97.8	Very high	93.4	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.4	179.2	172.4	67.2	0	0	0	108.5	F351 S355 H356 W358 L439 F457 V460	F351-L432 HydrophobicContact CB-CD2 3.73Å; F351-L432 HydrophobicContact CD2-CD2 3.97Å; F351-L432 HydrophobicContact CG-CD2 4.12Å; S355-L432 CarbonylContact C-O 3.57Å; S355-L432 WeakPolarHBondContact CA-O 3.48Å; H356-L432 HydrophobicContact CB-CB 4.49Å; H356-L432 PolarHBondContact N-O 2.85Å; H356-L432 PolarHBondContact O-N 3.49Å; W358-L432 HydrophobicContact CH2-CB 4.31Å; W358-L432 HydrophobicContact CZ3-CB 4.11Å; L432-L439 HydrophobicContact CB-CD1 4.05Å; L432-L439 HydrophobicContact CD1-CB 4.47Å; L432-L439 HydrophobicContact CD1-CD1 4.09Å; L432-F457 HydrophobicContact CD1-CD2 3.8Å; L432-F457 HydrophobicContact CD1-CE2 4.04Å; L432-V460 HydrophobicContact CD2-CG2 3.65Å
433	E	97.4	Very high	94.6	Very high	48 Å²	48	46.1 Å²	46.1	22%	0.224	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	108.5	169.3	-177.9	53.9	-100.3	0	0	108.5	S355 E436 G437 E438	S355-E433 VanDerWaalsContact CB-OE2 3.27Å; S355-E433 WeakPolarHBondContact CB-OE2 3.39Å; S355-E433 PolarHBondContact OG-OE2 2.7Å; E433-E436 HydrophobicContact CG-CB 3.72Å; E433-E436 HydrophobicContact CG-CG 3.9Å; E433-G437 WeakPolarHBondContact O-CA 3.27Å; E433-G437 PolarHBondContact O-N 3.05Å; E433-G437 VanDerWaalsContact O-N 3.13Å; E433-E438 HydrophobicContact CB-CB 4.23Å; E433-E438 PolarHBondContact N-O 2.97Å; E433-E438 PolarHBondContact O-N 2.93Å; E433-E438 VanDerWaalsContact O-N 3.08Å
434	C	93.7	Very high	95.2	Very high	25 Å²	25	44.6 Å²	44.6	17%	0.169	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-36.5	-170.3	-63.2	0	0	0	0	111.8	G354	G354-C434 PolarHBondContact O-N 3.44Å; G354-C434 PolarHBondContact O-SG 2.78Å
435	E	92.8	Very high	95.4	Very high	111 Å²	111	46.4 Å²	46.4	52%	0.519	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-49.2	-173.5	-76.5	74.7	-177.2	0	0	111.7	G354 G437	G354-E435 VanDerWaalsContact CA-OE2 3.28Å; G354-E435 WeakPolarHBondContact CA-OE2 3.4Å; G354-E435 PolarHBondContact N-OE1 2.97Å; G354-E435 PolarHBondContact N-OE2 3.31Å; E435-G437 PolarHBondContact O-N 3.15Å
436	E	92.5	Very high	95.3	Very high	150 Å²	150	54 Å²	54	70%	0.701	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.7	177.2	-59.9	-57.5	137.7	0	0	112.1	E433 E438	E433-E436 HydrophobicContact CG-CB 3.72Å; E433-E436 HydrophobicContact CG-CG 3.9Å; E436-E438 HydrophobicContact CB-CG 4.09Å
437	G	94.6	Very high	95.2	Very high	5 Å²	5	54.7 Å²	54.7	5%	0.052	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	40.6	180	0	0	0	0	0	112.2	E433 E435 H454 A455 F457	E433-G437 WeakPolarHBondContact O-CA 3.27Å; E433-G437 PolarHBondContact O-N 3.05Å; E433-G437 VanDerWaalsContact O-N 3.13Å; E435-G437 PolarHBondContact O-N 3.15Å; G437-H454 CarbonylContact O-C 3.55Å; G437-H454 WeakPolarHBondContact O-CA 3.42Å; G437-A455 CarbonylContact C-O 3.58Å; G437-A455 WeakPolarHBondContact CA-O 3.22Å; G437-A455 PolarHBondContact O-N 3.49Å; G437-A455 VanDerWaalsContact O-O 3.11Å; G437-F457 VanDerWaalsContact O-CE2 3.28Å; G437-F457 WeakPolarHBondContact O-CE2 3.42Å
438	E	97.4	Very high	95	Very high	76 Å²	76	52.4 Å²	52.4	36%	0.355	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132	177.8	-55.1	-164.1	154.2	0	0	111.7	E433 E436 T452 F453 H454	E433-E438 HydrophobicContact CB-CB 4.23Å; E433-E438 PolarHBondContact N-O 2.97Å; E433-E438 PolarHBondContact O-N 2.93Å; E433-E438 VanDerWaalsContact O-N 3.08Å; E436-E438 HydrophobicContact CB-CG 4.09Å; E438-T452 HydrophobicContact CB-CG2 4.28Å; E438-F453 WeakPolarHBondContact CA-O 3.42Å; E438-H454 IonicContact OE1-CE1 2.52Å; E438-H454 PolarHBondContact OE1-CE1 3.49Å; E438-H454 IonicContact OE1-ND1 3.39Å; E438-H454 PolarHBondContact OE1-ND1 3.48Å
439	L	98.1	Very high	94.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	105.9	171	176.9	73.5	0	0	0	108.9	V372 W397 V430 E431 L432 F441 T452 F453 F457	V372-L439 HydrophobicContact CG1-CD1 4.14Å; V372-L439 HydrophobicContact CG2-CD1 4.43Å; V372-L439 HydrophobicContact CG2-CD2 3.68Å; W397-L439 HydrophobicContact CB-CD2 3.52Å; V430-L439 HydrophobicContact CG1-CD1 3.62Å; E431-L439 CarbonylContact O-C 3.48Å; E431-L439 WeakPolarHBondContact O-CA 3.3Å; L432-L439 HydrophobicContact CB-CD1 4.05Å; L432-L439 HydrophobicContact CD1-CB 4.47Å; L432-L439 HydrophobicContact CD1-CD1 4.09Å; L439-F441 HydrophobicContact CD1-CE2 4.48Å; L439-F441 HydrophobicContact CD1-CZ 4.39Å; L439-F441 HydrophobicContact CD2-CE2 3.66Å; L439-F441 HydrophobicContact CD2-CZ 3.71Å; L439-F441 HydrophobicContact CG-CE2 3.63Å; L439-F441 HydrophobicContact CG-CZ 3.91Å; L439-T452 CarbonylContact O-C 3.47Å; L439-T452 VanDerWaalsContact O-CA 3.32Å; L439-T452 WeakPolarHBondContact O-CA 3.31Å; L439-F453 HydrophobicContact CB-CB 4.34Å; L439-F453 HydrophobicContact CD2-CD2 4.12Å; L439-F453 PolarHBondContact N-O 3.37Å; L439-F453 PolarHBondContact O-N 2.74Å; L439-F457 HydrophobicContact CB-CE1 4.18Å; L439-F457 HydrophobicContact CB-CE2 3.87Å; L439-F457 HydrophobicContact CB-CZ 3.47Å; L439-F457 VanDerWaalsContact CB-CZ 3.47Å
440	S	97.5	Very high	94.6	Very high	8 Å²	8	52.9 Å²	52.9	6%	0.056	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	142.1	-173.1	-64.2	0	0	0	0	111.7	V430 E431 Y451 T452	V430-S440 WeakPolarHBondContact CA-O 3.37Å; E431-S440 PolarHBondContact N-O 2.77Å; E431-S440 PolarHBondContact O-N 3.08Å; S440-Y451 CarbonylContact C-O 3.56Å; S440-Y451 WeakPolarHBondContact CA-O 3.3Å; S440-T452 VanDerWaalsContact OG-CG2 3.24Å; S440-T452 WeakPolarHBondContact OG-CG2 3.22Å; S440-T452 PolarHBondContact OG-OG1 3.35Å
441	F	97.3	Very high	94.5	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.3	-179.9	-65.1	-91.9	0	0	0	110.3	V370 V399 L428 R429 V430 L439 L450 Y451 F453	V370-F441 VanDerWaalsContact O-CE1 3.3Å; V370-F441 WeakPolarHBondContact O-CE1 3.49Å; V399-F441 HydrophobicContact CB-CD1 4.21Å; V399-F441 HydrophobicContact CB-CE1 4.42Å; V399-F441 HydrophobicContact CB-CG 4.37Å; V399-F441 HydrophobicContact CG2-CB 4Å; V399-F441 HydrophobicContact CG2-CD1 3.86Å; V399-F441 HydrophobicContact CG2-CD2 3.62Å; V399-F441 HydrophobicContact CG2-CE1 4.2Å; V399-F441 HydrophobicContact CG2-CE2 4Å; V399-F441 HydrophobicContact CG2-CG 3.54Å; V399-F441 HydrophobicContact CG2-CZ 4.26Å; L428-F441 HydrophobicContact CD1-CB 4.49Å; L428-F441 HydrophobicContact CD2-CD1 3.91Å; L428-F441 HydrophobicContact CD2-CE1 4.39Å; L428-F441 HydrophobicContact CG-CD1 4.32Å; R429-F441 WeakPolarHBondContact O-CA 3.49Å; V430-F441 HydrophobicContact CB-CE1 4.47Å; V430-F441 HydrophobicContact CG1-CD1 4.34Å; V430-F441 HydrophobicContact CG1-CE1 3.94Å; V430-F441 HydrophobicContact CG1-CZ 4.33Å; V430-F441 HydrophobicContact CG2-CD1 3.9Å; V430-F441 HydrophobicContact CG2-CE1 3.82Å; L439-F441 HydrophobicContact CD1-CE2 4.48Å; L439-F441 HydrophobicContact CD1-CZ 4.39Å; L439-F441 HydrophobicContact CD2-CE2 3.66Å; L439-F441 HydrophobicContact CD2-CZ 3.71Å; L439-F441 HydrophobicContact CG-CE2 3.63Å; L439-F441 HydrophobicContact CG-CZ 3.91Å; F441-L450 HydrophobicContact CB-CB 4.29Å; F441-L450 WeakPolarHBondContact O-CB 3.03Å; F441-L450 PolarHBondContact O-N 2.92Å; F441-Y451 PolarHBondContact N-O 2.88Å; F441-Y451 PolarHBondContact O-N 2.89Å; F441-F453 HydrophobicContact CD2-CD2 4.34Å; F441-F453 HydrophobicContact CD2-CE2 4.24Å; F441-F453 AromaticContact CE2-CD2 3.72Å; F441-F453 HydrophobicContact CE2-CD2 3.72Å; F441-F453 AromaticContact CE2-CE2 3.58Å; F441-F453 HydrophobicContact CE2-CE2 3.58Å; F441-F453 HydrophobicContact CZ-CE2 4.41Å
442	Y	95.5	Very high	94.3	Very high	61 Å²	61	53.8 Å²	53.8	24%	0.239	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.8	-179.5	-52.2	-101.8	0	0	0	111.2	R429 E431 A444 C448 H449	R429-Y442 HydrophobicContact CG-CD2 4.48Å; R429-Y442 PolarHBondContact N-O 2.87Å; R429-Y442 PolarHBondContact O-N 3.49Å; E431-Y442 HydrophobicContact CB-CE2 4.31Å; E431-Y442 HydrophobicContact CG-CD2 4.36Å; E431-Y442 HydrophobicContact CG-CE2 3.92Å; E431-Y442 WeakPolarHBondContact OE2-CE2 3.49Å; E431-Y442 PolarHBondContact OE2-OH 2.89Å; Y442-A444 PolarHBondContact O-N 3.27Å; Y442-C448 CarbonylContact C-O 3.54Å; Y442-C448 VanDerWaalsContact CA-O 3.27Å; Y442-C448 WeakPolarHBondContact CA-O 3.45Å; Y442-C448 WeakPolarHBondContact CB-O 3.48Å; Y442-H449 VanDerWaalsContact CD1-CA 3.48Å; Y442-H449 HydrophobicContact CD1-CB 3.88Å; Y442-H449 HydrophobicContact CE1-CB 3.88Å; Y442-H449 AromaticContact CE1-CD2 3.79Å
443	D	94.4	Very high	94.3	Very high	4 Å²	4	54 Å²	54	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	110.9	160.6	-175.8	-32.3	0	0	0	107.7	P425 E445 R446 H447 C448 L450	P425-D443 HydrophobicContact CB-CB 4.08Å; D443-E445 VanDerWaalsContact C-N 3.27Å; D443-E445 PolarHBondContact O-N 3.25Å; D443-E445 PolarHBondContact OD1-N 2.93Å; D443-R446 HydrophobicContact CB-CB 4.17Å; D443-R446 PolarHBondContact OD1-N 3.33Å; D443-R446 VanDerWaalsContact OD2-CD 3.29Å; D443-R446 WeakPolarHBondContact OD2-CD 3.37Å; D443-R446 WeakPolarHBondContact OD2-CG 3.4Å; D443-R446 IonicContact OD2-NE 2.7Å; D443-H447 VanDerWaalsContact O-CA 3.31Å; D443-H447 WeakPolarHBondContact O-CA 3.33Å; D443-H447 PolarHBondContact O-N 3.5Å; D443-C448 PolarHBondContact N-O 3Å; D443-C448 PolarHBondContact O-N 2.92Å; D443-L450 HydrophobicContact CB-CD2 4.18Å
444	A	93.6	Very high	94.2	Very high	8 Å²	8	58 Å²	58	7%	0.066	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-22.1	-175.2	0	0	0	0	0	112.9	E359 R427 R429 Y442 H447	E359-A444 HydrophobicContact CG-CB 4.43Å; R427-A444 HydrophobicContact CB-CB 4.07Å; R427-A444 HydrophobicContact CG-CB 3.89Å; R427-A444 PolarHBondContact O-N 3.45Å; R429-A444 HydrophobicContact CB-CB 4.16Å; Y442-A444 PolarHBondContact O-N 3.27Å; A444-H447 PolarHBondContact O-CE1 3.5Å
445	E	91	Very high	94.1	Very high	86 Å²	86	58.3 Å²	58.3	40%	0.402	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-36.9	179.3	-58.7	-165.6	151.5	0	0	111.7	R427 D443	R427-E445 HydrophobicContact CB-CG 4.03Å; R427-E445 IonicContact CZ-OE1 2.95Å; R427-E445 IonicContact NE-OE1 3.1Å; R427-E445 IonicContact NH2-OE1 3.53Å; R427-E445 PolarHBondContact NH2-OE1 3.38Å; R427-E445 VanDerWaalsContact NH2-OE1 3.09Å; D443-E445 VanDerWaalsContact C-N 3.27Å; D443-E445 PolarHBondContact O-N 3.25Å; D443-E445 PolarHBondContact OD1-N 2.93Å
446	R	90.6	Very high	94	Very high	161 Å²	161	64 Å²	64	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.8	178.9	-60.8	-177.1	-177.4	-153.8	-2	113.3	D443 C448	D443-R446 HydrophobicContact CB-CB 4.17Å; D443-R446 PolarHBondContact OD1-N 3.33Å; D443-R446 VanDerWaalsContact OD2-CD 3.29Å; D443-R446 WeakPolarHBondContact OD2-CD 3.37Å; D443-R446 WeakPolarHBondContact OD2-CG 3.4Å; D443-R446 IonicContact OD2-NE 2.7Å; R446-C448 HydrophobicContact CB-CB 4.5Å; R446-C448 PolarHBondContact O-N 3.18Å
447	H	89.7	Confident	93.9	Very high	165 Å²	165	57 Å²	57	76%	0.764	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	39.3	-173.9	-57.6	-69.4	0	0	0	112.6	D443 A444	D443-H447 VanDerWaalsContact O-CA 3.31Å; D443-H447 WeakPolarHBondContact O-CA 3.33Å; D443-H447 PolarHBondContact O-N 3.5Å; A444-H447 PolarHBondContact O-CE1 3.5Å
448	C	91.7	Very high	93.7	Very high	43 Å²	43	59 Å²	59	29%	0.291	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.6	-179.4	73.7	0	0	0	0	111.8	Y442 D443 R446	Y442-C448 CarbonylContact C-O 3.54Å; Y442-C448 VanDerWaalsContact CA-O 3.27Å; Y442-C448 WeakPolarHBondContact CA-O 3.45Å; Y442-C448 WeakPolarHBondContact CB-O 3.48Å; D443-C448 PolarHBondContact N-O 3Å; D443-C448 PolarHBondContact O-N 2.92Å; R446-C448 HydrophobicContact CB-CB 4.5Å; R446-C448 PolarHBondContact O-N 3.18Å
449	H	93.7	Very high	93.6	Very high	93 Å²	93	59.9 Å²	59.9	43%	0.431	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	139.8	173.1	174.7	-97	0	0	0	110.5	Y442 Y451 T452	Y442-H449 VanDerWaalsContact CD1-CA 3.48Å; Y442-H449 HydrophobicContact CD1-CB 3.88Å; Y442-H449 HydrophobicContact CE1-CB 3.88Å; Y442-H449 AromaticContact CE1-CD2 3.79Å; H449-Y451 PolarHBondContact CE1-N 3.39Å; H449-Y451 VanDerWaalsContact NE2-C 3.26Å; H449-Y451 PolarHBondContact NE2-O 3.35Å; H449-T452 PolarHBondContact NE2-OG1 3.16Å
450	L	92	Very high	93.5	Very high	13 Å²	13	59.9 Å²	59.9	7%	0.068	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-52.7	177.1	-56.8	-179.9	0	0	0	110.8	L420 L422 P425 L428 F441 D443	L420-L450 HydrophobicContact CD1-CB 4.48Å; L422-L450 HydrophobicContact CB-CD2 4.38Å; L422-L450 HydrophobicContact CD1-CD2 3.49Å; L422-L450 VanDerWaalsContact CD1-CD2 3.49Å; P425-L450 HydrophobicContact CG-CD1 4.09Å; L428-L450 HydrophobicContact CD1-CD1 3.39Å; F441-L450 HydrophobicContact CB-CB 4.29Å; F441-L450 WeakPolarHBondContact O-CB 3.03Å; F441-L450 PolarHBondContact O-N 2.92Å; D443-L450 HydrophobicContact CB-CD2 4.18Å
451	Y	94.2	Very high	93.5	Very high	43 Å²	43	61.3 Å²	61.3	17%	0.169	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	152.1	-175.2	-167.9	-104.6	0	0	0	112.1	T412 T417 L420 S440 F441 H449 F453	T412-Y451 HydrophobicContact CG2-CD1 3.67Å; T412-Y451 HydrophobicContact CG2-CD2 3.89Å; T412-Y451 HydrophobicContact CG2-CE1 3.92Å; T412-Y451 HydrophobicContact CG2-CE2 4.13Å; T412-Y451 HydrophobicContact CG2-CG 3.63Å; T417-Y451 HydrophobicContact CG2-CD2 4.25Å; T417-Y451 HydrophobicContact CG2-CE2 3.57Å; T417-Y451 PolarHBondContact OG1-OH 2.82Å; L420-Y451 HydrophobicContact CD2-CD2 4.05Å; S440-Y451 CarbonylContact C-O 3.56Å; S440-Y451 WeakPolarHBondContact CA-O 3.3Å; F441-Y451 PolarHBondContact N-O 2.88Å; F441-Y451 PolarHBondContact O-N 2.89Å; H449-Y451 PolarHBondContact CE1-N 3.39Å; H449-Y451 VanDerWaalsContact NE2-C 3.26Å; H449-Y451 PolarHBondContact NE2-O 3.35Å; Y451-F453 HydrophobicContact CD1-CD1 4.45Å; Y451-F453 AromaticContact CD1-CD2 3.74Å; Y451-F453 HydrophobicContact CD1-CD2 3.74Å; Y451-F453 HydrophobicContact CD1-CE1 4.39Å; Y451-F453 AromaticContact CD1-CE2 3.66Å; Y451-F453 HydrophobicContact CD1-CE2 3.66Å; Y451-F453 HydrophobicContact CD1-CG 4.17Å; Y451-F453 HydrophobicContact CD1-CZ 4.03Å; Y451-F453 AromaticContact CE1-CD1 3.65Å; Y451-F453 HydrophobicContact CE1-CD1 3.65Å; Y451-F453 AromaticContact CE1-CD2 3.76Å; Y451-F453 HydrophobicContact CE1-CD2 3.76Å; Y451-F453 AromaticContact CE1-CE1 3.69Å; Y451-F453 HydrophobicContact CE1-CE1 3.69Å; Y451-F453 AromaticContact CE1-CE2 3.8Å; Y451-F453 HydrophobicContact CE1-CE2 3.8Å; Y451-F453 AromaticContact CE1-CG 3.71Å; Y451-F453 HydrophobicContact CE1-CG 3.71Å; Y451-F453 AromaticContact CE1-CZ 3.79Å; Y451-F453 HydrophobicContact CE1-CZ 3.79Å
452	T	95.7	Very high	93.5	Very high	26 Å²	26	61.3 Å²	61.3	16%	0.16	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128.9	170.9	-60.8	0	0	0	0	110.3	E438 L439 S440 H449	E438-T452 HydrophobicContact CB-CG2 4.28Å; L439-T452 CarbonylContact O-C 3.47Å; L439-T452 VanDerWaalsContact O-CA 3.32Å; L439-T452 WeakPolarHBondContact O-CA 3.31Å; S440-T452 VanDerWaalsContact OG-CG2 3.24Å; S440-T452 WeakPolarHBondContact OG-CG2 3.22Å; S440-T452 PolarHBondContact OG-OG1 3.35Å; H449-T452 PolarHBondContact NE2-OG1 3.16Å
453	F	96	Very high	93.5	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.035	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	139.2	165.5	-63.7	-93.1	0	0	0	109.7	T392 W397 D414 E438 L439 F441 Y451 F457	T392-F453 HydrophobicContact CG2-CD1 4Å; T392-F453 HydrophobicContact CG2-CE1 3.6Å; W397-F453 HydrophobicContact CB-CD2 4.25Å; W397-F453 HydrophobicContact CB-CE2 4.36Å; W397-F453 HydrophobicContact CB-CG 4.31Å; W397-F453 AromaticContact CD1-CD1 3.65Å; W397-F453 AromaticContact CD1-CG 3.91Å; W397-F453 HydrophobicContact CG-CD1 4.49Å; D414-F453 HydrophobicContact CB-CE1 3.98Å; E438-F453 WeakPolarHBondContact CA-O 3.42Å; L439-F453 HydrophobicContact CB-CB 4.34Å; L439-F453 HydrophobicContact CD2-CD2 4.12Å; L439-F453 PolarHBondContact N-O 3.37Å; L439-F453 PolarHBondContact O-N 2.74Å; F441-F453 HydrophobicContact CD2-CD2 4.34Å; F441-F453 HydrophobicContact CD2-CE2 4.24Å; F441-F453 AromaticContact CE2-CD2 3.72Å; F441-F453 HydrophobicContact CE2-CD2 3.72Å; F441-F453 AromaticContact CE2-CE2 3.58Å; F441-F453 HydrophobicContact CE2-CE2 3.58Å; F441-F453 HydrophobicContact CZ-CE2 4.41Å; Y451-F453 HydrophobicContact CD1-CD1 4.45Å; Y451-F453 AromaticContact CD1-CD2 3.74Å; Y451-F453 HydrophobicContact CD1-CD2 3.74Å; Y451-F453 HydrophobicContact CD1-CE1 4.39Å; Y451-F453 AromaticContact CD1-CE2 3.66Å; Y451-F453 HydrophobicContact CD1-CE2 3.66Å; Y451-F453 HydrophobicContact CD1-CG 4.17Å; Y451-F453 HydrophobicContact CD1-CZ 4.03Å; Y451-F453 AromaticContact CE1-CD1 3.65Å; Y451-F453 HydrophobicContact CE1-CD1 3.65Å; Y451-F453 AromaticContact CE1-CD2 3.76Å; Y451-F453 HydrophobicContact CE1-CD2 3.76Å; Y451-F453 AromaticContact CE1-CE1 3.69Å; Y451-F453 HydrophobicContact CE1-CE1 3.69Å; Y451-F453 AromaticContact CE1-CE2 3.8Å; Y451-F453 HydrophobicContact CE1-CE2 3.8Å; Y451-F453 AromaticContact CE1-CG 3.71Å; Y451-F453 HydrophobicContact CE1-CG 3.71Å; Y451-F453 AromaticContact CE1-CZ 3.79Å; Y451-F453 HydrophobicContact CE1-CZ 3.79Å; F453-F457 HydrophobicContact CB-CE1 4.41Å; F453-F457 HydrophobicContact CB-CZ 4.23Å
454	H	95.3	Very high	93.6	Very high	132 Å²	132	58.2 Å²	58.2	61%	0.611	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	111.4	168.5	-61.5	-85.6	0	0	0	109.1	G437 E438	G437-H454 CarbonylContact O-C 3.55Å; G437-H454 WeakPolarHBondContact O-CA 3.42Å; E438-H454 IonicContact OE1-CE1 2.52Å; E438-H454 PolarHBondContact OE1-CE1 3.49Å; E438-H454 IonicContact OE1-ND1 3.39Å; E438-H454 PolarHBondContact OE1-ND1 3.48Å
455	A	92	Very high	93.6	Very high	31 Å²	31	59.8 Å²	59.8	26%	0.256	28%	0.281	S	S	.	.	S	Bend	trans	-159.9	157.8	177.8	0	0	0	0	0	111.8	W397 G437 F457	W397-A455 HydrophobicContact CZ2-CB 4.38Å; G437-A455 CarbonylContact C-O 3.58Å; G437-A455 WeakPolarHBondContact CA-O 3.22Å; G437-A455 PolarHBondContact O-N 3.49Å; G437-A455 VanDerWaalsContact O-O 3.11Å; A455-F457 HydrophobicContact CB-CD1 4.09Å; A455-F457 HydrophobicContact CB-CE1 3.74Å; A455-F457 HydrophobicContact CB-CZ 4.24Å; A455-F457 WeakPolarHBondContact O-CD2 3.28Å; A455-F457 PolarHBondContact O-N 3.01Å; A455-F457 VanDerWaalsContact O-N 3.1Å
456	R	90.9	Very high	93.5	Very high	230 Å²	230	55.8 Å²	55.8	87%	0.868	26%	0.263	S	S	*	.			trans	-78.2	94.5	167.3	-67	-176.3	178.9	-168.1	-1.5	109.3	R374	R374-R456 PolarHBondContact NH2-O 3.17Å
457	F	90.3	Very high	93.2	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.018	24%	0.24	C	C	.	.			trans	-70.2	-35.4	-172.4	-58.8	-61.8	0	0	0	114.1	R374 W397 L432 G437 L439 F453 A455 V460	R374-F457 VanDerWaalsContact CZ-O 3.23Å; R374-F457 PolarHBondContact NE-O 3.19Å; R374-F457 PolarHBondContact NH2-O 3.49Å; W397-F457 HydrophobicContact CB-CE1 4.41Å; W397-F457 AromaticContact CD1-CE1 3.81Å; W397-F457 AromaticContact CD2-CD1 3.61Å; W397-F457 HydrophobicContact CD2-CD1 3.61Å; W397-F457 AromaticContact CD2-CE1 3.72Å; W397-F457 HydrophobicContact CD2-CE1 3.72Å; W397-F457 AromaticContact CE2-CD1 3.7Å; W397-F457 AromaticContact CE2-CE1 3.82Å; W397-F457 AromaticContact CE3-CD1 3.77Å; W397-F457 HydrophobicContact CE3-CD1 3.77Å; W397-F457 HydrophobicContact CE3-CE1 4.31Å; W397-F457 HydrophobicContact CG-CD1 4.14Å; W397-F457 AromaticContact CG-CE1 3.74Å; W397-F457 HydrophobicContact CG-CE1 3.74Å; W397-F457 HydrophobicContact CH2-CD1 4.14Å; W397-F457 AromaticContact CZ2-CD1 3.98Å; W397-F457 HydrophobicContact CZ2-CD1 3.98Å; W397-F457 HydrophobicContact CZ2-CE1 4.49Å; W397-F457 HydrophobicContact CZ3-CD1 4.02Å; W397-F457 AromaticContact NE1-CE1 3.84Å; L432-F457 HydrophobicContact CD1-CD2 3.8Å; L432-F457 HydrophobicContact CD1-CE2 4.04Å; G437-F457 VanDerWaalsContact O-CE2 3.28Å; G437-F457 WeakPolarHBondContact O-CE2 3.42Å; L439-F457 HydrophobicContact CB-CE1 4.18Å; L439-F457 HydrophobicContact CB-CE2 3.87Å; L439-F457 HydrophobicContact CB-CZ 3.47Å; L439-F457 VanDerWaalsContact CB-CZ 3.47Å; F453-F457 HydrophobicContact CB-CE1 4.41Å; F453-F457 HydrophobicContact CB-CZ 4.23Å; A455-F457 HydrophobicContact CB-CD1 4.09Å; A455-F457 HydrophobicContact CB-CE1 3.74Å; A455-F457 HydrophobicContact CB-CZ 4.24Å; A455-F457 WeakPolarHBondContact O-CD2 3.28Å; A455-F457 PolarHBondContact O-N 3.01Å; A455-F457 VanDerWaalsContact O-N 3.1Å; F457-V460 HydrophobicContact CB-CG1 3.75Å
458	G	91.3	Very high	92.4	Very high	47 Å²	47	43.3 Å²	43.3	49%	0.485	23%	0.229	S	C	.	.			trans	70.5	-151.7	-169.9	0	0	0	0	0	111.2	V460	G458-V460 PolarHBondContact O-N 3.08Å
459	E	94.6	Very high	91.1	Very high	94 Å²	94	44.5 Å²	44.5	44%	0.439	24%	0.242	S	C	.	.	S	Bend	trans	-71.9	124.2	172.5	-61.1	-172.1	164	0	0	110.4	V350 F351 R374 V375	V350-E459 HydrophobicContact CG1-CB 3.93Å; F351-E459 WeakPolarHBondContact O-CA 3.41Å; R374-E459 WeakPolarHBondContact CA-O 3.32Å; V375-E459 HydrophobicContact CB-CB 4.22Å; V375-E459 HydrophobicContact CG2-CB 4.33Å; V375-E459 PolarHBondContact N-O 2.77Å
460	V	95.8	Very high	89.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154	-178.7	-65.1	0	0	0	0	112.8	V350 F351 V372 V373 W397 L432 F457 G458	V350-V460 CarbonylContact C-O 3.57Å; V350-V460 WeakPolarHBondContact CA-O 3.31Å; F351-V460 HydrophobicContact CB-CG2 4.11Å; F351-V460 PolarHBondContact N-O 3.34Å; F351-V460 PolarHBondContact O-N 3.01Å; V372-V460 HydrophobicContact CB-CB 4.1Å; V372-V460 HydrophobicContact CB-CG2 4.23Å; V372-V460 HydrophobicContact CG1-CG2 4.49Å; V372-V460 HydrophobicContact CG2-CB 4.28Å; V372-V460 HydrophobicContact CG2-CG1 4.26Å; V372-V460 HydrophobicContact CG2-CG2 4.38Å; V373-V460 CarbonylContact O-C 3.56Å; V373-V460 WeakPolarHBondContact O-CA 3.25Å; V373-V460 WeakPolarHBondContact O-CB 3.34Å; W397-V460 HydrophobicContact CZ3-CG1 4.28Å; L432-V460 HydrophobicContact CD2-CG2 3.65Å; F457-V460 HydrophobicContact CB-CG1 3.75Å; G458-V460 PolarHBondContact O-N 3.08Å
461	R	97	Very high	87.8	Confident	38 Å²	38	53.2 Å²	53.2	14%	0.143	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147.1	168.4	-68	179.4	67.4	174.7	2	109.9	D307 L346 G347 R349 V350 V372 V373 V375 Y463	D307-R461 IonicContact OD2-CZ 3.09Å; D307-R461 IonicContact OD2-NH1 3.33Å; D307-R461 IonicContact OD2-NH2 2.67Å; D307-R461 PolarHBondContact OD2-NH2 2.88Å; L346-R461 HydrophobicContact CB-CB 4.46Å; L346-R461 HydrophobicContact CD1-CB 4.39Å; G347-R461 VanDerWaalsContact O-CZ 3.24Å; G347-R461 PolarHBondContact O-NE 3.19Å; G347-R461 PolarHBondContact O-NH2 3.3Å; R349-R461 WeakPolarHBondContact O-CG 3.25Å; V350-R461 HydrophobicContact CB-CG 4.47Å; V350-R461 HydrophobicContact CG2-CG 3.77Å; V372-R461 CarbonylContact C-O 3.46Å; V372-R461 VanDerWaalsContact CA-O 3.28Å; V372-R461 WeakPolarHBondContact CA-O 3.32Å; V373-R461 HydrophobicContact CG1-CB 4.39Å; V373-R461 PolarHBondContact N-O 2.95Å; V373-R461 PolarHBondContact O-N 2.88Å; V375-R461 HydrophobicContact CG2-CG 3.77Å; R461-Y463 PolarHBondContact O-N 3.46Å
462	P	97.8	Very high	85.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	133.9	166.5	-29.1	38.6	0	0	0	111.2	F304 L346 G347 R349 F351 W358 F464	F304-P462 HydrophobicContact CD1-CG 3.97Å; F304-P462 HydrophobicContact CD2-CB 4.35Å; F304-P462 HydrophobicContact CD2-CG 4.1Å; F304-P462 HydrophobicContact CE1-CB 4.2Å; F304-P462 HydrophobicContact CE1-CG 3.62Å; F304-P462 HydrophobicContact CE2-CB 3.66Å; F304-P462 HydrophobicContact CE2-CG 3.77Å; F304-P462 HydrophobicContact CG-CG 4.21Å; F304-P462 HydrophobicContact CZ-CB 3.57Å; F304-P462 HydrophobicContact CZ-CG 3.52Å; L346-P462 CarbonylContact C-O 3.54Å; L346-P462 VanDerWaalsContact CA-O 3.27Å; L346-P462 WeakPolarHBondContact CA-O 3.15Å; G347-P462 PolarHBondContact N-O 2.76Å; R349-P462 WeakPolarHBondContact O-CD 3.46Å; F351-P462 HydrophobicContact CD2-CG 4.24Å; F351-P462 HydrophobicContact CE2-CG 3.57Å; F351-P462 HydrophobicContact CZ-CG 4.48Å; W358-P462 HydrophobicContact CZ2-CB 4.4Å; W358-P462 HydrophobicContact CZ2-CG 4.42Å; P462-F464 HydrophobicContact CB-CD2 4.45Å; P462-F464 HydrophobicContact CB-CE2 3.44Å; P462-F464 VanDerWaalsContact CB-CE2 3.44Å; P462-F464 HydrophobicContact CB-CZ 3.81Å
463	Y	96.8	Very high	84.4	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	134	-176.8	170.8	-102.3	0	0	0	110.3	C344 L346 R369 G371 F396 Y398 R461	C344-Y463 HydrophobicContact CB-CE2 3.64Å; L346-Y463 HydrophobicContact CD2-CD2 3.99Å; R369-Y463 HydrophobicContact CB-CE1 4.17Å; G371-Y463 PolarHBondContact N-O 3.18Å; G371-Y463 PolarHBondContact O-N 2.65Å; F396-Y463 HydrophobicContact CD1-CD1 4.32Å; F396-Y463 HydrophobicContact CD1-CD2 4.07Å; F396-Y463 HydrophobicContact CD1-CE1 4.26Å; F396-Y463 HydrophobicContact CD1-CE2 4Å; F396-Y463 HydrophobicContact CD1-CG 4.23Å; F396-Y463 AromaticContact CE1-CD2 3.92Å; F396-Y463 HydrophobicContact CE1-CD2 3.92Å; F396-Y463 AromaticContact CE1-CE2 3.73Å; F396-Y463 HydrophobicContact CE1-CE2 3.73Å; Y398-Y463 HydrophobicContact CD1-CD1 4.07Å; Y398-Y463 AromaticContact CD1-CE1 3.81Å; Y398-Y463 HydrophobicContact CD1-CE1 3.81Å; Y398-Y463 HydrophobicContact CE1-CE1 4.23Å; Y398-Y463 HydrophobicContact CG-CE1 4.4Å; R461-Y463 PolarHBondContact O-N 3.46Å
464	F	95.9	Very high	83	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143.1	-177.6	-54.7	-89.7	0	0	0	110.8	F304 F306 C344 L345 V360 R369 V370 P462 L478	F304-F464 AromaticContact CE2-CE2 3.8Å; F304-F464 HydrophobicContact CE2-CE2 3.8Å; F304-F464 AromaticContact CE2-CZ 3.62Å; F304-F464 HydrophobicContact CE2-CZ 3.62Å; F304-F464 HydrophobicContact CZ-CE2 4.3Å; F304-F464 AromaticContact CZ-CZ 3.77Å; F304-F464 HydrophobicContact CZ-CZ 3.77Å; F306-F464 AromaticContact CD1-CD2 3.99Å; F306-F464 HydrophobicContact CD1-CD2 3.99Å; F306-F464 HydrophobicContact CD1-CE2 4.09Å; F306-F464 HydrophobicContact CE1-CB 4.37Å; F306-F464 AromaticContact CE1-CD1 3.99Å; F306-F464 HydrophobicContact CE1-CD1 3.99Å; F306-F464 AromaticContact CE1-CD2 3.47Å; F306-F464 HydrophobicContact CE1-CD2 3.47Å; F306-F464 VanDerWaalsContact CE1-CD2 3.47Å; F306-F464 HydrophobicContact CE1-CE1 4.08Å; F306-F464 AromaticContact CE1-CE2 3.54Å; F306-F464 HydrophobicContact CE1-CE2 3.54Å; F306-F464 AromaticContact CE1-CG 3.68Å; F306-F464 HydrophobicContact CE1-CG 3.68Å; F306-F464 AromaticContact CE1-CZ 3.87Å; F306-F464 HydrophobicContact CE1-CZ 3.87Å; F306-F464 HydrophobicContact CZ-CD1 4.47Å; F306-F464 HydrophobicContact CZ-CE1 4.48Å; C344-F464 WeakPolarHBondContact CA-O 3.44Å; C344-F464 WeakPolarHBondContact CB-O 3.43Å; L345-F464 HydrophobicContact CD2-CB 3.59Å; L345-F464 HydrophobicContact CG-CB 4.45Å; L345-F464 PolarHBondContact N-O 2.88Å; L345-F464 PolarHBondContact O-N 2.81Å; L345-F464 VanDerWaalsContact O-N 3.09Å; V360-F464 HydrophobicContact CG2-CE1 3.92Å; R369-F464 CarbonylContact O-C 3.59Å; R369-F464 WeakPolarHBondContact O-CA 3.47Å; V370-F464 HydrophobicContact CG1-CD1 4.3Å; V370-F464 HydrophobicContact CG1-CE1 4.06Å; V370-F464 HydrophobicContact CG2-CD1 4.19Å; P462-F464 HydrophobicContact CB-CD2 4.45Å; P462-F464 HydrophobicContact CB-CE2 3.44Å; P462-F464 VanDerWaalsContact CB-CE2 3.44Å; P462-F464 HydrophobicContact CB-CZ 3.81Å; F464-L478 HydrophobicContact CD1-CD1 4.5Å; F464-L478 HydrophobicContact CD1-CD2 3.88Å; F464-L478 HydrophobicContact CE1-CD2 4.32Å
465	Y	92.5	Very high	81.8	Confident	41 Å²	41	58.5 Å²	58.5	16%	0.161	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.1	172	171.9	-76.6	0	0	0	109.4	A342 P343 C344 W368 R369	A342-Y465 HydrophobicContact CB-CD2 4.48Å; A342-Y465 HydrophobicContact CB-CE2 4.23Å; P343-Y465 VanDerWaalsContact CD-CE2 3.46Å; P343-Y465 HydrophobicContact CG-CD2 3.93Å; P343-Y465 HydrophobicContact CG-CE1 4.13Å; P343-Y465 HydrophobicContact CG-CE2 3.36Å; P343-Y465 VanDerWaalsContact CG-CZ 3.44Å; P343-Y465 CarbonylContact O-C 3.53Å; P343-Y465 VanDerWaalsContact O-CA 3.23Å; P343-Y465 WeakPolarHBondContact O-CA 3.16Å; P343-Y465 WeakPolarHBondContact O-CD2 3.44Å; C344-Y465 HydrophobicContact CB-CD2 4.39Å; W368-Y465 CarbonylContact C-O 3.53Å; W368-Y465 WeakPolarHBondContact CA-O 3.34Å; R369-Y465 HydrophobicContact CB-CG 4.42Å; R369-Y465 HydrophobicContact CG-CD1 3.81Å; R369-Y465 HydrophobicContact CG-CG 3.79Å; R369-Y465 PolarHBondContact N-O 3.3Å; R369-Y465 PolarHBondContact O-N 3.25Å
466	L	90.4	Very high	81.4	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.01	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	108	178	-75.6	87	0	0	0	111	L315 V324 N326 P343 L345 L478	L315-L466 HydrophobicContact CD2-CB 4.22Å; V324-L466 HydrophobicContact CG1-CD1 3.45Å; V324-L466 VanDerWaalsContact CG1-CD1 3.45Å; V324-L466 HydrophobicContact CG1-CD2 3.83Å; V324-L466 HydrophobicContact CG1-CG 4.29Å; V324-L466 HydrophobicContact CG2-CD1 4.35Å; V324-L466 HydrophobicContact CG2-CD2 4.44Å; V324-L466 VanDerWaalsContact O-CD2 3.27Å; V324-L466 WeakPolarHBondContact O-CD2 3.28Å; N326-L466 PolarHBondContact ND2-O 2.88Å; P343-L466 WeakPolarHBondContact CB-O 3.37Å; P343-L466 WeakPolarHBondContact CG-O 3.42Å; P343-L466 PolarHBondContact O-N 3.41Å; L345-L466 HydrophobicContact CD2-CD1 4.07Å; L466-L478 HydrophobicContact CD1-CB 4.06Å; L466-L478 HydrophobicContact CD1-CD1 3.97Å; L466-L478 HydrophobicContact CD1-CG 4.48Å; L466-L478 HydrophobicContact CD2-CB 3.59Å; L466-L478 HydrophobicContact CG-CB 3.95Å; L466-L478 HydrophobicContact CG-CD1 4.15Å
467	G	83.9	Confident	81.4	Confident	12 Å²	12	53.5 Å²	53.5	12%	0.124	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-65.7	154.7	173.5	0	0	0	0	0	112.1	S367	S367-G467 PolarHBondContact O-N 2.75Å
468	G	73.3	Confident	81.6	Confident	52 Å²	52	53.3 Å²	53.3	54%	0.536	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-67.4	145.4	177.2	0	0	0	0	0	112.4	N326	N326-G468 PolarHBondContact ND2-N 3.47Å
469	A	64.1	Low	81.9	Confident	68 Å²	68	55.7 Å²	55.7	56%	0.562	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-70.4	133.7	174.8	0	0	0	0	0	110.8
470	R	57	Low	82	Confident	232 Å²	232	51.2 Å²	51.2	88%	0.875	32%	0.318	S	S	*	.			trans	-90.3	1.4	174	-69.4	-172.5	-179.8	-175.3	2.7	113.7
471	G	58.8	Low	82	Confident	58 Å²	58	52.2 Å²	52.2	60%	0.598	33%	0.325	S	S	*	.	S	Bend	trans	-111.3	163	-172.5	0	0	0	0	0	114.5	G473	G471-G473 VanDerWaalsContact C-N 3.26Å; G471-G473 PolarHBondContact O-N 2.75Å
472	A	54	Low	81.9	Confident	120 Å²	120	53.6 Å²	53.6	99%	0.992	34%	0.339	S	S	*	.	S	Bend	trans	-79.4	5	-178.4	0	0	0	0	0	115.1
473	G	64.4	Low	81.6	Confident	49 Å²	49	57.3 Å²	57.3	51%	0.505	36%	0.358	S	S	.	.	S	Bend	trans	-89.8	167.1	178.6	0	0	0	0	0	113.2	G471	G471-G473 VanDerWaalsContact C-N 3.26Å; G471-G473 PolarHBondContact O-N 2.75Å
474	P	66.1	Low	81	Confident	122 Å²	122	65.8 Å²	65.8	79%	0.792	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-58.7	139.8	170.4	26.9	-33.2	0	0	0	109.6	E476	P474-E476 PolarHBondContact O-N 2.93Å
475	P	71	Confident	80.5	Confident	29 Å²	29	69.2 Å²	69.2	19%	0.188	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-65.7	128.7	-178.3	25.9	-31.9	0	0	0	110	H327	H327-P475 WeakPolarHBondContact CE1-CG 3.28Å; H327-P475 WeakPolarHBondContact ND1-CG 3.4Å
476	E	83.5	Confident	80.1	Confident	101 Å²	101	71.3 Å²	71.3	47%	0.472	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66	138	173.5	-68.5	-172.7	174.6	0	0	110.2	G364 L365 P474	G364-E476 WeakPolarHBondContact CA-OE2 3.39Å; G364-E476 PolarHBondContact N-OE2 3.39Å; L365-E476 HydrophobicContact CD2-CB 4.13Å; L365-E476 WeakPolarHBondContact CD2-O 3.26Å; P474-E476 PolarHBondContact O-N 2.93Å
477	P	91.1	Very high	79.9	Confident	54 Å²	54	74.1 Å²	74.1	35%	0.351	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-82.1	146.6	176.7	31.1	-32.8	0	0	0	112	V324 T325	V324-P477 WeakPolarHBondContact O-CA 3.46Å; T325-P477 HydrophobicContact CG2-CB 3.65Å
478	L	94.7	Very high	79.9	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	129.5	155.1	-174.6	151.4	0	0	0	107.3	F306 S323 V324 V360 L362 L365 V370 F464 L466	F306-L478 HydrophobicContact CE1-CD2 4.27Å; F306-L478 HydrophobicContact CE2-CD2 4.39Å; F306-L478 HydrophobicContact CZ-CD2 3.52Å; S323-L478 CarbonylContact C-O 3.24Å; S323-L478 VanDerWaalsContact CA-O 3.27Å; S323-L478 WeakPolarHBondContact CA-O 3.47Å; V324-L478 HydrophobicContact CG1-CB 4.04Å; V324-L478 HydrophobicContact CG1-CD2 4.21Å; V324-L478 PolarHBondContact N-O 3.11Å; V324-L478 PolarHBondContact O-N 3.35Å; V360-L478 HydrophobicContact CG1-CD1 4.12Å; V360-L478 HydrophobicContact CG1-CD2 3.43Å; V360-L478 VanDerWaalsContact CG1-CD2 3.43Å; V360-L478 HydrophobicContact CG1-CG 3.62Å; L362-L478 HydrophobicContact CD2-CD1 3.83Å; L362-L478 HydrophobicContact CD2-CG 4.29Å; L365-L478 HydrophobicContact CD1-CB 3.77Å; L365-L478 HydrophobicContact CD1-CD1 4.42Å; L365-L478 HydrophobicContact CD1-CG 4.44Å; V370-L478 HydrophobicContact CG2-CD1 4.12Å; F464-L478 HydrophobicContact CD1-CD1 4.5Å; F464-L478 HydrophobicContact CD1-CD2 3.88Å; F464-L478 HydrophobicContact CE1-CD2 4.32Å; L466-L478 HydrophobicContact CD1-CB 4.06Å; L466-L478 HydrophobicContact CD1-CD1 3.97Å; L466-L478 HydrophobicContact CD1-CG 4.48Å; L466-L478 HydrophobicContact CD2-CB 3.59Å; L466-L478 HydrophobicContact CG-CB 3.95Å; L466-L478 HydrophobicContact CG-CD1 4.15Å
479	R	96.6	Very high	80.5	Confident	97 Å²	97	85.5 Å²	85.5	37%	0.366	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.3	-174.8	175.5	-179.6	-67.7	-98.5	0.6	111.7	D320 T322 S323 V360 A361	D320-R479 IonicContact OD2-NH1 3.31Å; T322-R479 CarbonylContact O-C 3.59Å; T322-R479 WeakPolarHBondContact O-CA 3.46Å; T322-R479 PolarHBondContact OG1-NH1 3.45Å; S323-R479 WeakPolarHBondContact OG-CB 3.19Å; S323-R479 WeakPolarHBondContact OG-CG 3.14Å; S323-R479 PolarHBondContact OG-NE 3.24Å; S323-R479 VanDerWaalsContact OG-NE 3.08Å; S323-R479 PolarHBondContact OG-NH1 3.38Å; S323-R479 PolarHBondContact OG-NH2 2.84Å; V360-R479 CarbonylContact C-O 3.58Å; V360-R479 WeakPolarHBondContact CA-O 3.41Å; A361-R479 HydrophobicContact CB-CB 4.31Å; A361-R479 PolarHBondContact N-O 3Å; A361-R479 PolarHBondContact O-N 2.85Å; A361-R479 VanDerWaalsContact O-N 3.08Å
480	I	97.6	Very high	81.7	Confident	1 Å²	1	90 Å²	90	1%	0.005	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.8	168	-57.9	167.7	0	0	0	107.6	V302 P303 F304 F306 T322	V302-I480 HydrophobicContact CB-CG2 4.08Å; V302-I480 HydrophobicContact CG1-CB 4.5Å; V302-I480 HydrophobicContact CG1-CG2 4.12Å; P303-I480 HydrophobicContact CG-CG2 4.11Å; F304-I480 HydrophobicContact CD2-CD1 3.75Å; F304-I480 HydrophobicContact CE2-CD1 3.52Å; F304-I480 HydrophobicContact CE2-CG1 4.24Å; F304-I480 HydrophobicContact CZ-CD1 4.4Å; F304-I480 WeakPolarHBondContact O-CD1 3.25Å; F306-I480 HydrophobicContact CD1-CD1 4.26Å; F306-I480 HydrophobicContact CD2-CD1 4.12Å; F306-I480 HydrophobicContact CE1-CD1 3.98Å; F306-I480 HydrophobicContact CE1-CG1 4.17Å; F306-I480 HydrophobicContact CE2-CD1 3.86Å; F306-I480 HydrophobicContact CE2-CG1 3.81Å; F306-I480 HydrophobicContact CG-CD1 4.31Å; F306-I480 HydrophobicContact CZ-CD1 3.76Å; F306-I480 HydrophobicContact CZ-CG1 3.56Å; T322-I480 PolarHBondContact O-N 2.95Å
481	C	96.1	Very high	82.9	Confident	21 Å²	21	87 Å²	87	14%	0.142	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-73.7	140.7	179.3	-66.7	0	0	0	0	110.9	E359	E359-C481 HydrophobicContact CB-CB 3.72Å; E359-C481 PolarHBondContact O-N 3.06Å
482	P	94.1	Very high	83.7	Confident	67 Å²	67	92.4 Å²	92.4	44%	0.435	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-60.6	149.9	172.9	-22.9	33.4	0	0	0	112.7	S301	S301-P482 CarbonylContact O-C 3.56Å; S301-P482 VanDerWaalsContact O-CA 3.26Å; S301-P482 WeakPolarHBondContact O-CA 3.03Å
483	L	90.8	Very high	83.8	Confident	78 Å²	78	94 Å²	94	41%	0.408	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-73.6	143.9	171.6	-63.3	176.2	0	0	0	110.5	S301 P303 I485	S301-L483 PolarHBondContact O-N 3.1Å; P303-L483 HydrophobicContact CB-CD1 4.49Å; P303-L483 HydrophobicContact CB-CD2 4.19Å; P303-L483 HydrophobicContact CG-CD2 4.24Å; L483-I485 PolarHBondContact O-N 3.09Å
484	H	86.1	Confident	84.8	Confident	177 Å²	177	96.2 Å²	96.2	82%	0.819	54%	0.538	S	S	*	.			trans	-82.3	111.5	164.5	-175.6	65.9	0	0	0	109.5
485	I	84.9	Confident	85.7	Confident	72 Å²	72	94.8 Å²	94.8	37%	0.369	52%	0.524	S	S	.	.			trans	-92.3	124.4	179.1	-49	172.9	0	0	0	109.1	L296 L483	L296-I485 HydrophobicContact CD1-CB 4.37Å; L296-I485 HydrophobicContact CD1-CD1 3.76Å; L296-I485 HydrophobicContact CD1-CG2 4.06Å; L296-I485 HydrophobicContact CD2-CB 4.32Å; L296-I485 HydrophobicContact CD2-CG2 3.89Å; L296-I485 HydrophobicContact CG-CG2 4.39Å; L483-I485 PolarHBondContact O-N 3.09Å
486	S	84.7	Confident	86.6	Confident	86 Å²	86	98.5 Å²	98.5	60%	0.601	54%	0.543	S	S	*	.			trans	-120.5	141.1	172.9	59.9	0	0	0	0	110.1
487	I	84.3	Confident	86.7	Confident	60 Å²	60	98.4 Å²	98.4	31%	0.308	55%	0.547	S	S	.	.			trans	-102.7	126.8	176.9	-58.5	160.7	0	0	0	107.6	W292 K293 L296	W292-I487 HydrophobicContact CH2-CD1 3.79Å; W292-I487 HydrophobicContact CH2-CG1 4.15Å; W292-I487 HydrophobicContact CZ3-CD1 3.54Å; W292-I487 HydrophobicContact CZ3-CG1 4.32Å; K293-I487 HydrophobicContact CD-CD1 4.46Å; K293-I487 HydrophobicContact CG-CD1 4.02Å; L296-I487 HydrophobicContact CD2-CD1 3.61Å; L296-I487 HydrophobicContact CD2-CG1 3.83Å
488	K	85.8	Confident	86.5	Confident	169 Å²	169	101.1 Å²	101.1	74%	0.735	56%	0.559	S	S	*	*			trans	-103.6	129	169.7	-66	-176.4	179.7	-179	0	108.9
489	E	85.4	Confident	85.9	Confident	135 Å²	135	107.9 Å²	107.9	63%	0.631	60%	0.597	S	S	*	*			trans	-103.6	113.3	176.8	-66.3	172.2	-167.4	0	0	107.5	Y289 K293	Y289-E489 PolarHBondContact OH-OE1 2.87Å; K293-E489 IonicContact NZ-OE1 3.26Å; K293-E489 PolarHBondContact NZ-OE1 2.9Å
490	E	88.7	Confident	85.2	Confident	162 Å²	162	108.6 Å²	108.6	76%	0.757	61%	0.613	S	S	*	*			trans	-121.7	142.3	178.5	-66.8	177.7	-169.8	0	0	108.3
491	L	82.6	Confident	84.2	Confident	170 Å²	170	116.9 Å²	116.9	89%	0.89	66%	0.66	S	S	*	*			trans	-79.7	132.2	169.9	-69.1	168.6	0	0	0	107.3	G493	L491-G493 PolarHBondContact O-N 2.74Å; L491-G493 VanDerWaalsContact O-N 3.11Å
492	D	75.3	Confident	83.2	Confident	171 Å²	171	124.9 Å²	124.9	91%	0.914	70%	0.703	S	S	*	*			trans	-58.2	120	167.9	-71.5	-27.6	0	0	0	108
493	G	56.1	Low	82.2	Confident	152 Å²	152	130.2 Å²	130.2	100%	1.567	73%	0.727	S	S	*	*			trans	-73.5	0	-177.6	0	0	0	0	0	114.3	L491	L491-G493 PolarHBondContact O-N 2.74Å; L491-G493 VanDerWaalsContact O-N 3.11Å

Retrieved 493 of 493 residues in 2224.9 ms (Link to these results)

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